3-cyclohexyl-N-[5-(dimethylamino)-2-oxidanylidene-1-(phenylmethyl)-3H-1,4-benzodiazepin-3-yl]propanamide

Systemtic Name: 3-cyclohexyl-N-[5-(dimethylamino)-2-oxidanylidene-1-(phenylmethyl)-3H-1,4-benzodiazepin-3-yl]propanamide Openeye Name: N-[1-benzyl-5-(dimethylamino)-2-oxo-3H-1,4-benzodiazepin-3-yl]-3-cyclohexyl-propanamide CAS Name: 3-cyclohexyl-N-[5-(dimethylamino)-2-oxo-1-(phenylmethyl)-3H-1,4-benzodiazepin-3-yl]propanamide IUPAC Name: N-[1-benzyl-5-(dimethylamino)-2-oxo-3H-1,4-benzodiazepin-3-yl]-3-cyclohexylpropanamide Traditional Name: N-[1-benzyl-5-(dimethylamino)-2-keto-3H-1,4-benzodiazepin-3-yl]-3-cyclohexyl-propionamide Formula: C27H34N4O2 MolecularWeight: 446.58446

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(C(=O)N(C2=CC=CC=C21)CC3=CC=CC=C3)NC(=O)CCC4CCCCC4

Isomeric SMILES

CN(C)C1=NC(C(=O)N(C2=CC=CC=C21)CC3=CC=CC=C3)NC(=O)CCC4CCCCC4

InChI

InChI=1S/C27H34N4O2/c1-30(2)26-22-15-9-10-16-23(22)31(19-21-13-7-4-8-14-21)27(33)25(29-26)28-24(32)18-17-20-11-5-3-6-12-20/h4,7-10,13-16,20,25H,3,5-6,11-12,17-19H2,1-2H3,(H,28,32)