N-(4-methylphenyl)-2-methylsulfanyl-pyrimidine-5-carboxamide

Systemtic Name: N-(4-methylphenyl)-2-methylsulfanyl-pyrimidine-5-carboxamide Openeye Name: 2-methylsulfanyl-N-(p-tolyl)pyrimidine-5-carboxamide CAS Name: N-(4-methylphenyl)-2-(methylthio)-5-pyrimidinecarboxamide IUPAC Name: N-(4-methylphenyl)-2-methylsulfanylpyrimidine-5-carboxamide Traditional Name: 2-(methylthio)-N-(p-tolyl)pyrimidine-5-carboxamide Formula: C13H13N3OS MolecularWeight: 259.32682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=CN=C(N=C2)SC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=CN=C(N=C2)SC

InChI

InChI=1S/C13H13N3OS/c1-9-3-5-11(6-4-9)16-12(17)10-7-14-13(18-2)15-8-10/h3-8H,1-2H3,(H,16,17)