N-[(4-nitrophenyl)carbamoyl]-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[(4-nitrophenyl)carbamoyl]-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-[(4-nitrophenyl)carbamoyl]-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-[(4-nitroanilino)-oxomethyl]-2-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-[(4-nitrophenyl)carbamoyl]-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-[(4-nitrophenyl)carbamoyl]-2-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]acetamide Formula: C14H10F3N5O4S MolecularWeight: 401.32051

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)NC(=O)CSC2=NC=CC(=N2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)NC(=O)CSC2=NC=CC(=N2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H10F3N5O4S/c15-14(16,17)10-5-6-18-13(20-10)27-7-11(23)21-12(24)19-8-1-3-9(4-2-8)22(25)26/h1-6H,7H2,(H2,19,21,23,24)