N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzamide

Systemtic Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzamide Openeye Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-3-[(2-oxopyrrolidin-1-yl)methyl]benzamide CAS Name: N-[4-[(2,5-dimethylphenyl)thio]phenyl]-3-[(2-oxo-1-pyrrolidinyl)methyl]benzamide IUPAC Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-3-[(2-oxopyrrolidin-1-yl)methyl]benzamide Traditional Name: N-[4-[(2,5-dimethylphenyl)thio]phenyl]-3-[(2-ketopyrrolidino)methyl]benzamide Formula: C26H26N2O2S MolecularWeight: 430.56184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)CN4CCCC4=O

Isomeric SMILES

CC1=CC(=C(C=C1)C)SC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)CN4CCCC4=O

InChI

InChI=1S/C26H26N2O2S/c1-18-8-9-19(2)24(15-18)31-23-12-10-22(11-13-23)27-26(30)21-6-3-5-20(16-21)17-28-14-4-7-25(28)29/h3,5-6,8-13,15-16H,4,7,14,17H2,1-2H3,(H,27,30)