tert-butyl N-[7-azanyl-7-cyclohexyl-1-(4H-imidazol-4-yl)-5-oxidanyl-3-oxidanylidene-heptan-2-yl]-N-(2-azanyl-3-phenyl-propanoyl)carbamate

Systemtic Name: tert-butyl N-[7-azanyl-7-cyclohexyl-1-(4H-imidazol-4-yl)-5-oxidanyl-3-oxidanylidene-heptan-2-yl]-N-(2-azanyl-3-phenyl-propanoyl)carbamate Openeye Name: tert-butyl N-[6-amino-6-cyclohexyl-4-hydroxy-1-(4H-imidazol-4-ylmethyl)-2-oxo-hexyl]-N-(2-amino-3-phenyl-propanoyl)carbamate CAS Name: N-[7-amino-7-cyclohexyl-5-hydroxy-1-(4H-imidazol-4-yl)-3-oxoheptan-2-yl]-N-(2-amino-1-oxo-3-phenylpropyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[7-amino-7-cyclohexyl-5-hydroxy-1-(4H-imidazol-4-yl)-3-oxoheptan-2-yl]-N-(2-amino-3-phenylpropanoyl)carbamate Traditional Name: N-[6-amino-6-cyclohexyl-4-hydroxy-1-(4H-imidazol-4-ylmethyl)-2-keto-hexyl]-N-phenylalanyl-carbamic acid tert-butyl ester Formula: C30H45N5O5 MolecularWeight: 555.7088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C(CC1C=NC=N1)C(=O)CC(CC(C2CCCCC2)N)O)C(=O)C(CC3=CC=CC=C3)N

Isomeric SMILES

CC(C)(C)OC(=O)N(C(CC1C=NC=N1)C(=O)CC(CC(C2CCCCC2)N)O)C(=O)C(CC3=CC=CC=C3)N

InChI

InChI=1S/C30H45N5O5/c1-30(2,3)40-29(39)35(28(38)25(32)14-20-10-6-4-7-11-20)26(15-22-18-33-19-34-22)27(37)17-23(36)16-24(31)21-12-8-5-9-13-21/h4,6-7,10-11,18-19,21-26,36H,5,8-9,12-17,31-32H2,1-3H3