phenyl 2-[[1-cyclohexyl-5-(3,3-dimethyl-2-oxidanylidene-butyl)-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepin-3-yl]carbamoylamino]-2-methyl-propanoate

Systemtic Name: phenyl 2-[[1-cyclohexyl-5-(3,3-dimethyl-2-oxidanylidene-butyl)-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepin-3-yl]carbamoylamino]-2-methyl-propanoate Openeye Name: phenyl 2-[[1-cyclohexyl-5-(3,3-dimethyl-2-oxo-butyl)-4-oxo-2,3-dihydro-1,5-benzodiazepin-3-yl]carbamoylamino]-2-methyl-propanoate CAS Name: 2-[[[[1-cyclohexyl-5-(3,3-dimethyl-2-oxobutyl)-4-oxo-2,3-dihydro-1,5-benzodiazepin-3-yl]amino]-oxomethyl]amino]-2-methylpropanoic acid phenyl ester IUPAC Name: phenyl 2-[[1-cyclohexyl-5-(3,3-dimethyl-2-oxobutyl)-4-oxo-2,3-dihydro-1,5-benzodiazepin-3-yl]carbamoylamino]-2-methylpropanoate Traditional Name: 2-[[1-cyclohexyl-4-keto-5-(2-keto-3,3-dimethyl-butyl)-2,3-dihydro-1,5-benzodiazepin-3-yl]carbamoylamino]-2-methyl-propionic acid phenyl ester Formula: C32H42N4O5 MolecularWeight: 562.69968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C2=CC=CC=C2N(CC(C1=O)NC(=O)NC(C)(C)C(=O)OC3=CC=CC=C3)C4CCCCC4

Isomeric SMILES

CC(C)(C)C(=O)CN1C2=CC=CC=C2N(CC(C1=O)NC(=O)NC(C)(C)C(=O)OC3=CC=CC=C3)C4CCCCC4

InChI

InChI=1S/C32H42N4O5/c1-31(2,3)27(37)21-36-26-19-13-12-18-25(26)35(22-14-8-6-9-15-22)20-24(28(36)38)33-30(40)34-32(4,5)29(39)41-23-16-10-7-11-17-23/h7,10-13,16-19,22,24H,6,8-9,14-15,20-21H2,1-5H3,(H2,33,34,40)