1-[(3-methoxyphenyl)methyl]-3-(2-methylpropyl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide

Systemtic Name: 1-[(3-methoxyphenyl)methyl]-3-(2-methylpropyl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Openeye Name: 3-isobutyl-1-[(3-methoxyphenyl)methyl]-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide CAS Name: 1-[(3-methoxyphenyl)methyl]-3-(2-methylpropyl)-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide IUPAC Name: 1-[(3-methoxyphenyl)methyl]-3-(2-methylpropyl)-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Traditional Name: 3-isobutyl-4-keto-1-m-anisyl-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1CN(C2=C(C=C(C=C2)C(=O)N)NC1=O)CC3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)CC1CN(C2=C(C=C(C=C2)C(=O)N)NC1=O)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C22H27N3O3/c1-14(2)9-17-13-25(12-15-5-4-6-18(10-15)28-3)20-8-7-16(21(23)26)11-19(20)24-22(17)27/h4-8,10-11,14,17H,9,12-13H2,1-3H3,(H2,23,26)(H,24,27)