N-[[4-(4-fluorophenyl)-5-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-methoxy-benzamide

Systemtic Name: N-[[4-(4-fluorophenyl)-5-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-methoxy-benzamide Openeye Name: N-[[5-[2-(4-fluoroanilino)-2-oxo-ethyl]sulfanyl-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]-4-methoxy-benzamide CAS Name: N-[[5-[[2-(4-fluoroanilino)-2-oxoethyl]thio]-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]-4-methoxybenzamide IUPAC Name: N-[[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]-4-methoxybenzamide Traditional Name: N-[[5-[[2-(4-fluoroanilino)-2-keto-ethyl]thio]-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]-4-methoxy-benzamide Formula: C25H21F2N5O3S MolecularWeight: 509.527746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C3=CC=C(C=C3)F)SCC(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C3=CC=C(C=C3)F)SCC(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C25H21F2N5O3S/c1-35-21-12-2-16(3-13-21)24(34)28-14-22-30-31-25(32(22)20-10-6-18(27)7-11-20)36-15-23(33)29-19-8-4-17(26)5-9-19/h2-13H,14-15H2,1H3,(H,28,34)(H,29,33)