[4-methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,2,4-triazol-3-yl]-phenyl-methanol

Systemtic Name: [4-methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,2,4-triazol-3-yl]-phenyl-methanol Openeye Name: [4-methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,2,4-triazol-3-yl]-phenyl-methanol CAS Name: [4-methyl-5-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-1,2,4-triazol-3-yl]-phenylmethanol IUPAC Name: [4-methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,2,4-triazol-3-yl]-phenylmethanol Traditional Name: [4-methyl-5-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-1,2,4-triazol-3-yl]-phenyl-methanol Formula: C17H13F3N4O3S MolecularWeight: 410.37033

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(C3=CC=CC=C3)O

Isomeric SMILES

CN1C(=NN=C1SC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(C3=CC=CC=C3)O

InChI

InChI=1S/C17H13F3N4O3S/c1-23-15(14(25)10-5-3-2-4-6-10)21-22-16(23)28-13-8-7-11(17(18,19)20)9-12(13)24(26)27/h2-9,14,25H,1H3