5-chloranyl-N-methyl-2-methylsulfanyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-methyl-2-methylsulfanyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-methyl-2-methylsulfanyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]pyrimidine-4-carboxamide CAS Name: 5-chloro-N-methyl-2-(methylthio)-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-methyl-2-methylsulfanyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]pyrimidine-4-carboxamide Traditional Name: 5-chloro-N-methyl-2-(methylthio)-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]pyrimidine-4-carboxamide Formula: C17H17ClN6OS MolecularWeight: 388.87448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=NC=N2)N(C)C(=O)C3=NC(=NC=C3Cl)SC

Isomeric SMILES

CC(C1=CC=C(C=C1)N2C=NC=N2)N(C)C(=O)C3=NC(=NC=C3Cl)SC

InChI

InChI=1S/C17H17ClN6OS/c1-11(12-4-6-13(7-5-12)24-10-19-9-21-24)23(2)16(25)15-14(18)8-20-17(22-15)26-3/h4-11H,1-3H3