1-(3-methylbutyl)-3-(2-methylsulfanylethyl)-3,4-dihydro-1,4-benzodiazepine-2,5-dione

Systemtic Name: 1-(3-methylbutyl)-3-(2-methylsulfanylethyl)-3,4-dihydro-1,4-benzodiazepine-2,5-dione Openeye Name: 1-isopentyl-3-(2-methylsulfanylethyl)-3,4-dihydro-1,4-benzodiazepine-2,5-dione CAS Name: 1-(3-methylbutyl)-3-[2-(methylthio)ethyl]-3,4-dihydro-1,4-benzodiazepine-2,5-dione IUPAC Name: 1-(3-methylbutyl)-3-(2-methylsulfanylethyl)-3,4-dihydro-1,4-benzodiazepine-2,5-dione Traditional Name: 1-isoamyl-3-[2-(methylthio)ethyl]-3,4-dihydro-1,4-benzodiazepine-2,5-quinone Formula: C17H24N2O2S MolecularWeight: 320.44966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=CC=CC=C2C(=O)NC(C1=O)CCSC

Isomeric SMILES

CC(C)CCN1C2=CC=CC=C2C(=O)NC(C1=O)CCSC

InChI

InChI=1S/C17H24N2O2S/c1-12(2)8-10-19-15-7-5-4-6-13(15)16(20)18-14(17(19)21)9-11-22-3/h4-7,12,14H,8-11H2,1-3H3,(H,18,20)