4-[(4-methylphenyl)sulfanylmethyl]-N-(2-pyrrolidin-1-ylcarbonylphenyl)benzamide

Systemtic Name: 4-[(4-methylphenyl)sulfanylmethyl]-N-(2-pyrrolidin-1-ylcarbonylphenyl)benzamide Openeye Name: 4-(p-tolylsulfanylmethyl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]benzamide CAS Name: 4-[[(4-methylphenyl)thio]methyl]-N-[2-[oxo(1-pyrrolidinyl)methyl]phenyl]benzamide IUPAC Name: 4-[(4-methylphenyl)sulfanylmethyl]-N-[2-(pyrrolidine-1-carbonyl)phenyl]benzamide Traditional Name: 4-[(p-tolylthio)methyl]-N-[2-(pyrrolidine-1-carbonyl)phenyl]benzamide Formula: C26H26N2O2S MolecularWeight: 430.56184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)N4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)N4CCCC4

InChI

InChI=1S/C26H26N2O2S/c1-19-8-14-22(15-9-19)31-18-20-10-12-21(13-11-20)25(29)27-24-7-3-2-6-23(24)26(30)28-16-4-5-17-28/h2-3,6-15H,4-5,16-18H2,1H3,(H,27,29)