N-(2-azanylethyl)-2-cyclohexyl-1-(3-methoxyphenyl)carbonyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide

Systemtic Name: N-(2-azanylethyl)-2-cyclohexyl-1-(3-methoxyphenyl)carbonyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Openeye Name: N-(2-aminoethyl)-2-cyclohexyl-1-(3-methoxybenzoyl)-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide CAS Name: N-(2-aminoethyl)-2-cyclohexyl-1-[(3-methoxyphenyl)-oxomethyl]-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide IUPAC Name: N-(2-aminoethyl)-2-cyclohexyl-1-(3-methoxybenzoyl)-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Traditional Name: N-(2-aminoethyl)-2-cyclohexyl-4-keto-1-m-anisoyl-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Formula: C26H32N4O4 MolecularWeight: 464.55668

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2C(CC(=O)NC3=C2C=CC(=C3)C(=O)NCCN)C4CCCCC4

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2C(CC(=O)NC3=C2C=CC(=C3)C(=O)NCCN)C4CCCCC4

InChI

InChI=1S/C26H32N4O4/c1-34-20-9-5-8-19(14-20)26(33)30-22-11-10-18(25(32)28-13-12-27)15-21(22)29-24(31)16-23(30)17-6-3-2-4-7-17/h5,8-11,14-15,17,23H,2-4,6-7,12-13,16,27H2,1H3,(H,28,32)(H,29,31)