4-[(4-methylphenyl)sulfanylmethyl]-N-(pyridin-4-ylmethyl)benzamide

Systemtic Name: 4-[(4-methylphenyl)sulfanylmethyl]-N-(pyridin-4-ylmethyl)benzamide Openeye Name: 4-(p-tolylsulfanylmethyl)-N-(4-pyridylmethyl)benzamide CAS Name: 4-[[(4-methylphenyl)thio]methyl]-N-(pyridin-4-ylmethyl)benzamide IUPAC Name: 4-[(4-methylphenyl)sulfanylmethyl]-N-(pyridin-4-ylmethyl)benzamide Traditional Name: 4-[(p-tolylthio)methyl]-N-(4-pyridylmethyl)benzamide Formula: C21H20N2OS MolecularWeight: 348.4613

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=CC=C(C=C2)C(=O)NCC3=CC=NC=C3

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=CC=C(C=C2)C(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C21H20N2OS/c1-16-2-8-20(9-3-16)25-15-18-4-6-19(7-5-18)21(24)23-14-17-10-12-22-13-11-17/h2-13H,14-15H2,1H3,(H,23,24)