5-chloranyl-2-methylsulfanyl-N-(4-propylphenyl)pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-methylsulfanyl-N-(4-propylphenyl)pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-methylsulfanyl-N-(4-propylphenyl)pyrimidine-4-carboxamide CAS Name: 5-chloro-2-(methylthio)-N-(4-propylphenyl)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-methylsulfanyl-N-(4-propylphenyl)pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(methylthio)-N-(4-propylphenyl)pyrimidine-4-carboxamide Formula: C15H16ClN3OS MolecularWeight: 321.82504

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)NC(=O)C2=NC(=NC=C2Cl)SC

Isomeric SMILES

CCCC1=CC=C(C=C1)NC(=O)C2=NC(=NC=C2Cl)SC

InChI

InChI=1S/C15H16ClN3OS/c1-3-4-10-5-7-11(8-6-10)18-14(20)13-12(16)9-17-15(19-13)21-2/h5-9H,3-4H2,1-2H3,(H,18,20)