N-(2,4-dimethylphenyl)-4-[(4-methylpyrimidin-2-yl)sulfanylmethyl]benzamide

Systemtic Name: N-(2,4-dimethylphenyl)-4-[(4-methylpyrimidin-2-yl)sulfanylmethyl]benzamide Openeye Name: N-(2,4-dimethylphenyl)-4-[(4-methylpyrimidin-2-yl)sulfanylmethyl]benzamide CAS Name: N-(2,4-dimethylphenyl)-4-[[(4-methyl-2-pyrimidinyl)thio]methyl]benzamide IUPAC Name: N-(2,4-dimethylphenyl)-4-[(4-methylpyrimidin-2-yl)sulfanylmethyl]benzamide Traditional Name: N-(2,4-dimethylphenyl)-4-[[(4-methylpyrimidin-2-yl)thio]methyl]benzamide Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=CC=C(C=C2)CSC3=NC=CC(=N3)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=CC=C(C=C2)CSC3=NC=CC(=N3)C)C

InChI

InChI=1S/C21H21N3OS/c1-14-4-9-19(15(2)12-14)24-20(25)18-7-5-17(6-8-18)13-26-21-22-11-10-16(3)23-21/h4-12H,13H2,1-3H3,(H,24,25)