N-[2-chloranyl-5-(trifluoromethyl)phenyl]-3-(6-methylpyrimidin-4-yl)sulfanyl-propanamide

Systemtic Name: N-[2-chloranyl-5-(trifluoromethyl)phenyl]-3-(6-methylpyrimidin-4-yl)sulfanyl-propanamide Openeye Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-3-(6-methylpyrimidin-4-yl)sulfanyl-propanamide CAS Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-3-[(6-methyl-4-pyrimidinyl)thio]propanamide IUPAC Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-3-(6-methylpyrimidin-4-yl)sulfanylpropanamide Traditional Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-3-[(6-methylpyrimidin-4-yl)thio]propionamide Formula: C15H13ClF3N3OS MolecularWeight: 375.79643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=N1)SCCC(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl

Isomeric SMILES

CC1=CC(=NC=N1)SCCC(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl

InChI

InChI=1S/C15H13ClF3N3OS/c1-9-6-14(21-8-20-9)24-5-4-13(23)22-12-7-10(15(17,18)19)2-3-11(12)16/h2-3,6-8H,4-5H2,1H3,(H,22,23)