N-[1-[[1-[[5-[[1-[(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-1-cyclohexyl-3-oxidanyl-5-oxidanylidene-pentan-2-yl]amino]-3-(1H-imidazol-2-yl)-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-1-[3-(1H-imidazol-5-yl)-2-(3-methylbutanoylamino)propanoyl]pyrrolidine-2-carboxamide

Systemtic Name: N-[1-[[1-[[5-[[1-[(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-1-cyclohexyl-3-oxidanyl-5-oxidanylidene-pentan-2-yl]amino]-3-(1H-imidazol-2-yl)-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-1-[3-(1H-imidazol-5-yl)-2-(3-methylbutanoylamino)propanoyl]pyrrolidine-2-carboxamide Openeye Name: N-[2-[[2-[[4-[[1-[(2-amino-1-benzyl-2-oxo-ethyl)carbamoyl]-3-methyl-butyl]amino]-1-(cyclohexylmethyl)-2-hydroxy-4-oxo-butyl]amino]-1-(1H-imidazol-2-ylmethyl)-2-oxo-ethyl]amino]-1-benzyl-2-oxo-ethyl]-1-[3-(1H-imidazol-5-yl)-2-(3-methylbutanoylamino)propanoyl]pyrrolidine-2-carboxamide CAS Name: N-[1-[[1-[[5-[[1-[(1-amino-1-oxo-3-phenylpropan-2-yl)amino]-4-methyl-1-oxopentan-2-yl]amino]-1-cyclohexyl-3-hydroxy-5-oxopentan-2-yl]amino]-3-(1H-imidazol-2-yl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-1-[3-(1H-imidazol-5-yl)-2-[(3-methyl-1-oxobutyl)amino]-1-oxopropyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[1-[[1-[[5-[[1-[(1-amino-1-oxo-3-phenylpropan-2-yl)amino]-4-methyl-1-oxopentan-2-yl]amino]-1-cyclohexyl-3-hydroxy-5-oxopentan-2-yl]amino]-3-(1H-imidazol-2-yl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-1-[3-(1H-imidazol-5-yl)-2-(3-methylbutanoylamino)propanoyl]pyrrolidine-2-carboxamide Traditional Name: N-[2-[[2-[[4-[[1-[(2-amino-1-benzyl-2-keto-ethyl)carbamoyl]-3-methyl-butyl]amino]-1-(cyclohexylmethyl)-2-hydroxy-4-keto-butyl]amino]-1-(1H-imidazol-2-ylmethyl)-2-keto-ethyl]amino]-1-benzyl-2-keto-ethyl]-1-[3-(1H-imidazol-5-yl)-2-(isovalerylamino)propanoyl]pyrrolidine-2-carboxamide Formula: C57H80N12O9 MolecularWeight: 1077.3201

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)N)NC(=O)CC(C(CC2CCCCC2)NC(=O)C(CC3=NC=CN3)NC(=O)C(CC4=CC=CC=C4)NC(=O)C5CCCN5C(=O)C(CC6=CN=CN6)NC(=O)CC(C)C)O

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)N)NC(=O)CC(C(CC2CCCCC2)NC(=O)C(CC3=NC=CN3)NC(=O)C(CC4=CC=CC=C4)NC(=O)C5CCCN5C(=O)C(CC6=CN=CN6)NC(=O)CC(C)C)O

InChI

InChI=1S/C57H80N12O9/c1-35(2)25-43(53(74)66-42(52(58)73)28-38-17-10-6-11-18-38)63-51(72)32-48(70)41(27-37-15-8-5-9-16-37)65-55(76)45(31-49-60-22-23-61-49)67-54(75)44(29-39-19-12-7-13-20-39)68-56(77)47-21-14-24-69(47)57(78)46(30-40-33-59-34-62-40)64-50(71)26-36(3)4/h6-7,10-13,17-20,22-23,33-37,41-48,70H,5,8-9,14-16,21,24-32H2,1-4H3,(H2,58,73)(H,59,62)(H,60,61)(H,63,72)(H,64,71)(H,65,76)(H,66,74)(H,67,75)(H,68,77)