N-[(3-methylphenyl)methyl]-2-methylsulfanyl-4-phenyl-pyrimidine-5-carboxamide

Systemtic Name: N-[(3-methylphenyl)methyl]-2-methylsulfanyl-4-phenyl-pyrimidine-5-carboxamide Openeye Name: 2-methylsulfanyl-N-(m-tolylmethyl)-4-phenyl-pyrimidine-5-carboxamide CAS Name: N-[(3-methylphenyl)methyl]-2-(methylthio)-4-phenyl-5-pyrimidinecarboxamide IUPAC Name: N-[(3-methylphenyl)methyl]-2-methylsulfanyl-4-phenylpyrimidine-5-carboxamide Traditional Name: N-(3-methylbenzyl)-2-(methylthio)-4-phenyl-pyrimidine-5-carboxamide Formula: C20H19N3OS MolecularWeight: 349.44936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=O)C2=CN=C(N=C2C3=CC=CC=C3)SC

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=O)C2=CN=C(N=C2C3=CC=CC=C3)SC

InChI

InChI=1S/C20H19N3OS/c1-14-7-6-8-15(11-14)12-21-19(24)17-13-22-20(25-2)23-18(17)16-9-4-3-5-10-16/h3-11,13H,12H2,1-2H3,(H,21,24)