N-(2-methylphenyl)-3-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-propanamide

Systemtic Name: N-(2-methylphenyl)-3-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-propanamide Openeye Name: 3-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-N-(o-tolyl)propanamide CAS Name: N-(2-methylphenyl)-3-[(2-methyl-6-phenyl-4-pyrimidinyl)thio]propanamide IUPAC Name: N-(2-methylphenyl)-3-(2-methyl-6-phenylpyrimidin-4-yl)sulfanylpropanamide Traditional Name: 3-[(2-methyl-6-phenyl-pyrimidin-4-yl)thio]-N-(o-tolyl)propionamide Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CCSC2=NC(=NC(=C2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CCSC2=NC(=NC(=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C21H21N3OS/c1-15-8-6-7-11-18(15)24-20(25)12-13-26-21-14-19(22-16(2)23-21)17-9-4-3-5-10-17/h3-11,14H,12-13H2,1-2H3,(H,24,25)