N-[(3,4-dimethoxyphenyl)methyl]-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetamide Traditional Name: 2-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]-N-veratryl-acetamide Formula: C16H16F3N3O3S MolecularWeight: 387.37675

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CSC2=NC=CC(=N2)C(F)(F)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CSC2=NC=CC(=N2)C(F)(F)F)OC

InChI

InChI=1S/C16H16F3N3O3S/c1-24-11-4-3-10(7-12(11)25-2)8-21-14(23)9-26-15-20-6-5-13(22-15)16(17,18)19/h3-7H,8-9H2,1-2H3,(H,21,23)