N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-4-methyl-2-methylsulfanyl-pyrimidine-5-carboxamide

Systemtic Name: N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-4-methyl-2-methylsulfanyl-pyrimidine-5-carboxamide Openeye Name: N-(2-benzoyl-4-chloro-phenyl)-4-methyl-2-methylsulfanyl-pyrimidine-5-carboxamide CAS Name: N-(2-benzoyl-4-chlorophenyl)-4-methyl-2-(methylthio)-5-pyrimidinecarboxamide IUPAC Name: N-(2-benzoyl-4-chlorophenyl)-4-methyl-2-methylsulfanylpyrimidine-5-carboxamide Traditional Name: N-(2-benzoyl-4-chloro-phenyl)-4-methyl-2-(methylthio)pyrimidine-5-carboxamide Formula: C20H16ClN3O2S MolecularWeight: 397.87794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3)SC

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3)SC

InChI

InChI=1S/C20H16ClN3O2S/c1-12-16(11-22-20(23-12)27-2)19(26)24-17-9-8-14(21)10-15(17)18(25)13-6-4-3-5-7-13/h3-11H,1-2H3,(H,24,26)