N-[2-methoxy-5-(trifluoromethyl)phenyl]-2-(6-piperidin-1-ylpyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-methoxy-5-(trifluoromethyl)phenyl]-2-(6-piperidin-1-ylpyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-[2-methoxy-5-(trifluoromethyl)phenyl]-2-[6-(1-piperidyl)pyrimidin-4-yl]sulfanyl-acetamide CAS Name: N-[2-methoxy-5-(trifluoromethyl)phenyl]-2-[[6-(1-piperidinyl)-4-pyrimidinyl]thio]acetamide IUPAC Name: N-[2-methoxy-5-(trifluoromethyl)phenyl]-2-(6-piperidin-1-ylpyrimidin-4-yl)sulfanylacetamide Traditional Name: N-[2-methoxy-5-(trifluoromethyl)phenyl]-2-[(6-piperidinopyrimidin-4-yl)thio]acetamide Formula: C19H21F3N4O2S MolecularWeight: 426.45585

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(F)(F)F)NC(=O)CSC2=NC=NC(=C2)N3CCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(F)(F)F)NC(=O)CSC2=NC=NC(=C2)N3CCCCC3

InChI

InChI=1S/C19H21F3N4O2S/c1-28-15-6-5-13(19(20,21)22)9-14(15)25-17(27)11-29-18-10-16(23-12-24-18)26-7-3-2-4-8-26/h5-6,9-10,12H,2-4,7-8,11H2,1H3,(H,25,27)