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

Systemtic Name: N-(4-methyl-1,3-thiazol-2-yl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-benzamide Openeye Name: N-(4-methylthiazol-2-yl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-benzamide CAS Name: N-(4-methyl-2-thiazolyl)-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]benzamide IUPAC Name: N-(4-methyl-1,3-thiazol-2-yl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylbenzamide Traditional Name: N-(4-methylthiazol-2-yl)-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]benzamide Formula: C18H12F3N3O3S2 MolecularWeight: 439.43139

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)C2=CC=CC=C2SC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)NC(=O)C2=CC=CC=C2SC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H12F3N3O3S2/c1-10-9-28-17(22-10)23-16(25)12-4-2-3-5-14(12)29-15-7-6-11(18(19,20)21)8-13(15)24(26)27/h2-9H,1H3,(H,22,23,25)