2-methyl-N-[[5-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-3-nitro-benzamide

Systemtic Name: 2-methyl-N-[[5-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-3-nitro-benzamide Openeye Name: 2-methyl-N-[[5-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxo-ethyl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-3-nitro-benzamide CAS Name: 2-methyl-N-[[5-[[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]thio]-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-3-nitrobenzamide IUPAC Name: 2-methyl-N-[[5-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-3-nitrobenzamide Traditional Name: N-[[5-[[2-keto-2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]ethyl]thio]-4-[3-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]methyl]-2-methyl-3-nitro-benzamide Formula: C23H19F3N8O4S2 MolecularWeight: 592.57337

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCC2=NN=C(N2C3=CC=CC(=C3)C(F)(F)F)SCC(=O)NC4=NN=C(S4)C

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCC2=NN=C(N2C3=CC=CC(=C3)C(F)(F)F)SCC(=O)NC4=NN=C(S4)C

InChI

InChI=1S/C23H19F3N8O4S2/c1-12-16(7-4-8-17(12)34(37)38)20(36)27-10-18-30-32-22(39-11-19(35)28-21-31-29-13(2)40-21)33(18)15-6-3-5-14(9-15)23(24,25)26/h3-9H,10-11H2,1-2H3,(H,27,36)(H,28,31,35)