2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[2-pyrrolidin-1-yl-4-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[2-pyrrolidin-1-yl-4-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[2-pyrrolidin-1-yl-4-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-[2-(1-pyrrolidinyl)-4-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[2-pyrrolidin-1-yl-4-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-N-[2-pyrrolidino-4-(trifluoromethyl)phenyl]acetamide Formula: C19H21F3N4OS MolecularWeight: 410.45645

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=C(C=C(C=C2)C(F)(F)F)N3CCCC3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=C(C=C(C=C2)C(F)(F)F)N3CCCC3)C

InChI

InChI=1S/C19H21F3N4OS/c1-12-9-13(2)24-18(23-12)28-11-17(27)25-15-6-5-14(19(20,21)22)10-16(15)26-7-3-4-8-26/h5-6,9-10H,3-4,7-8,11H2,1-2H3,(H,25,27)