N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-ethanamide Openeye Name: N-[4-methyl-5-(2-pyridyl)thiazol-2-yl]-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-acetamide CAS Name: N-[4-methyl-5-(2-pyridinyl)-2-thiazolyl]-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetamide IUPAC Name: N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylacetamide Traditional Name: N-[4-methyl-5-(2-pyridyl)thiazol-2-yl]-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetamide Formula: C18H13F3N4O3S2 MolecularWeight: 454.44603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CSC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C3=CC=CC=N3

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CSC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C3=CC=CC=N3

InChI

InChI=1S/C18H13F3N4O3S2/c1-10-16(12-4-2-3-7-22-12)30-17(23-10)24-15(26)9-29-14-6-5-11(18(19,20)21)8-13(14)25(27)28/h2-8H,9H2,1H3,(H,23,24,26)