N-cyclohexyl-2-(4-methoxyphenyl)-4-[(4-methoxyphenyl)methyl]-5-oxidanylidene-3H-1,4-benzodiazepine-3-carboxamide

Systemtic Name: N-cyclohexyl-2-(4-methoxyphenyl)-4-[(4-methoxyphenyl)methyl]-5-oxidanylidene-3H-1,4-benzodiazepine-3-carboxamide Openeye Name: N-cyclohexyl-2-(4-methoxyphenyl)-4-[(4-methoxyphenyl)methyl]-5-oxo-3H-1,4-benzodiazepine-3-carboxamide CAS Name: N-cyclohexyl-2-(4-methoxyphenyl)-4-[(4-methoxyphenyl)methyl]-5-oxo-3H-1,4-benzodiazepine-3-carboxamide IUPAC Name: N-cyclohexyl-2-(4-methoxyphenyl)-4-[(4-methoxyphenyl)methyl]-5-oxo-3H-1,4-benzodiazepine-3-carboxamide Traditional Name: N-cyclohexyl-5-keto-2-(4-methoxyphenyl)-4-p-anisyl-3H-1,4-benzodiazepine-3-carboxamide Formula: C31H33N3O4 MolecularWeight: 511.61142

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)OC)C(=O)NC5CCCCC5

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)OC)C(=O)NC5CCCCC5

InChI

InChI=1S/C31H33N3O4/c1-37-24-16-12-21(13-17-24)20-34-29(30(35)32-23-8-4-3-5-9-23)28(22-14-18-25(38-2)19-15-22)33-27-11-7-6-10-26(27)31(34)36/h6-7,10-19,23,29H,3-5,8-9,20H2,1-2H3,(H,32,35)