1-[2-(4-methylsulfanylphenyl)ethanoyl]-4-(phenylmethyl)-1,4-diazepan-5-one

Systemtic Name: 1-[2-(4-methylsulfanylphenyl)ethanoyl]-4-(phenylmethyl)-1,4-diazepan-5-one Openeye Name: 4-benzyl-1-[2-(4-methylsulfanylphenyl)acetyl]-1,4-diazepan-5-one CAS Name: 1-[2-[4-(methylthio)phenyl]-1-oxoethyl]-4-(phenylmethyl)-1,4-diazepan-5-one IUPAC Name: 4-benzyl-1-[2-(4-methylsulfanylphenyl)acetyl]-1,4-diazepan-5-one Traditional Name: 4-benzyl-1-[2-[4-(methylthio)phenyl]acetyl]-1,4-diazepan-5-one Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CC(=O)N2CCC(=O)N(CC2)CC3=CC=CC=C3

Isomeric SMILES

CSC1=CC=C(C=C1)CC(=O)N2CCC(=O)N(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O2S/c1-26-19-9-7-17(8-10-19)15-21(25)22-12-11-20(24)23(14-13-22)16-18-5-3-2-4-6-18/h2-10H,11-16H2,1H3