tert-butyl N-[6-[(5-imidazol-2-ylidene-2-propan-2-yl-1H-imidazol-2-yl)methylamino]-3-oxidanyl-6-oxidanylidene-1-phenyl-5-(phenylmethyl)hexan-2-yl]carbamate

Systemtic Name: tert-butyl N-[6-[(5-imidazol-2-ylidene-2-propan-2-yl-1H-imidazol-2-yl)methylamino]-3-oxidanyl-6-oxidanylidene-1-phenyl-5-(phenylmethyl)hexan-2-yl]carbamate Openeye Name: tert-butyl N-[1,4-dibenzyl-2-hydroxy-5-[(5-imidazol-2-ylidene-2-isopropyl-1H-imidazol-2-yl)methylamino]-5-oxo-pentyl]carbamate CAS Name: N-[3-hydroxy-6-[[5-(2-imidazolylidene)-2-propan-2-yl-1H-imidazol-2-yl]methylamino]-6-oxo-1-phenyl-5-(phenylmethyl)hexan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-benzyl-3-hydroxy-6-[(5-imidazol-2-ylidene-2-propan-2-yl-1H-imidazol-2-yl)methylamino]-6-oxo-1-phenylhexan-2-yl]carbamate Traditional Name: N-[1,4-dibenzyl-2-hydroxy-5-[(4-imidazol-2-ylidene-2-isopropyl-3-imidazolin-2-yl)methylamino]-5-keto-pentyl]carbamic acid tert-butyl ester Formula: C34H44N6O4 MolecularWeight: 600.75096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(NC(=C2N=CC=N2)C=N1)CNC(=O)C(CC3=CC=CC=C3)CC(C(CC4=CC=CC=C4)NC(=O)OC(C)(C)C)O

Isomeric SMILES

CC(C)C1(NC(=C2N=CC=N2)C=N1)CNC(=O)C(CC3=CC=CC=C3)CC(C(CC4=CC=CC=C4)NC(=O)OC(C)(C)C)O

InChI

InChI=1S/C34H44N6O4/c1-23(2)34(38-21-28(40-34)30-35-16-17-36-30)22-37-31(42)26(18-24-12-8-6-9-13-24)20-29(41)27(19-25-14-10-7-11-15-25)39-32(43)44-33(3,4)5/h6-17,21,23,26-27,29,40-41H,18-20,22H2,1-5H3,(H,37,42)(H,39,43)