5-chloranyl-N-[1-(4-methylphenyl)ethyl]-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[1-(4-methylphenyl)ethyl]-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-methylsulfanyl-N-[1-(p-tolyl)ethyl]pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[1-(4-methylphenyl)ethyl]-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[1-(4-methylphenyl)ethyl]-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(methylthio)-N-[1-(p-tolyl)ethyl]pyrimidine-4-carboxamide Formula: C15H16ClN3OS MolecularWeight: 321.82504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C)NC(=O)C2=NC(=NC=C2Cl)SC

Isomeric SMILES

CC1=CC=C(C=C1)C(C)NC(=O)C2=NC(=NC=C2Cl)SC

InChI

InChI=1S/C15H16ClN3OS/c1-9-4-6-11(7-5-9)10(2)18-14(20)13-12(16)8-17-15(19-13)21-3/h4-8,10H,1-3H3,(H,18,20)