4-methyl-5-[2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]ethanoyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one

Systemtic Name: 4-methyl-5-[2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]ethanoyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: 4-methyl-5-[2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]acetyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: 4-methyl-5-[2-[methyl-[[4-(methylthio)phenyl]methyl]amino]-1-oxoethyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: 4-methyl-5-[2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]acetyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: 4-methyl-5-[2-[methyl-[4-(methylthio)benzyl]amino]acetyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C21H25N3O2S MolecularWeight: 383.5071

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1C(=O)CN(C)CC3=CC=C(C=C3)SC

Isomeric SMILES

CC1CC(=O)NC2=CC=CC=C2N1C(=O)CN(C)CC3=CC=C(C=C3)SC

InChI

InChI=1S/C21H25N3O2S/c1-15-12-20(25)22-18-6-4-5-7-19(18)24(15)21(26)14-23(2)13-16-8-10-17(27-3)11-9-16/h4-11,15H,12-14H2,1-3H3,(H,22,25)