N-(3-propan-2-ylphenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-propan-2-ylphenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(3-isopropylphenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(3-propan-2-ylphenyl)-2-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-(3-propan-2-ylphenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-m-cumenyl-2-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]acetamide Formula: C16H16F3N3OS MolecularWeight: 355.37795

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)NC(=O)CSC2=NC=CC(=N2)C(F)(F)F

Isomeric SMILES

CC(C)C1=CC(=CC=C1)NC(=O)CSC2=NC=CC(=N2)C(F)(F)F

InChI

InChI=1S/C16H16F3N3OS/c1-10(2)11-4-3-5-12(8-11)21-14(23)9-24-15-20-7-6-13(22-15)16(17,18)19/h3-8,10H,9H2,1-2H3,(H,21,23)