2-methylsulfanyl-4-propyl-N-[2-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide

Systemtic Name: 2-methylsulfanyl-4-propyl-N-[2-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide Openeye Name: 2-methylsulfanyl-4-propyl-N-[2-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide CAS Name: 2-(methylthio)-4-propyl-N-[2-(trifluoromethyl)phenyl]-5-pyrimidinecarboxamide IUPAC Name: 2-methylsulfanyl-4-propyl-N-[2-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide Traditional Name: 2-(methylthio)-4-propyl-N-[2-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide Formula: C16H16F3N3OS MolecularWeight: 355.37795

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NC=C1C(=O)NC2=CC=CC=C2C(F)(F)F)SC

Isomeric SMILES

CCCC1=NC(=NC=C1C(=O)NC2=CC=CC=C2C(F)(F)F)SC

InChI

InChI=1S/C16H16F3N3OS/c1-3-6-12-10(9-20-15(22-12)24-2)14(23)21-13-8-5-4-7-11(13)16(17,18)19/h4-5,7-9H,3,6H2,1-2H3,(H,21,23)