(4S)-4-methyl-5-[2-[(2-methylphenyl)methylsulfanyl]ethanoyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one

Systemtic Name: (4S)-4-methyl-5-[2-[(2-methylphenyl)methylsulfanyl]ethanoyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: (4S)-4-methyl-5-[2-(o-tolylmethylsulfanyl)acetyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: (4S)-4-methyl-5-[2-[(2-methylphenyl)methylthio]-1-oxoethyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: (4S)-4-methyl-5-[2-[(2-methylphenyl)methylsulfanyl]acetyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: (4S)-4-methyl-5-[2-[(2-methylbenzyl)thio]acetyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C20H22N2O2S MolecularWeight: 354.46588

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1C(=O)CSCC3=CC=CC=C3C

Isomeric SMILES

C[C@H]1CC(=O)NC2=CC=CC=C2N1C(=O)CSCC3=CC=CC=C3C

InChI

InChI=1S/C20H22N2O2S/c1-14-7-3-4-8-16(14)12-25-13-20(24)22-15(2)11-19(23)21-17-9-5-6-10-18(17)22/h3-10,15H,11-13H2,1-2H3,(H,21,23)/t15-/m0/s1