4-[[2-[[4,5-bis(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoylhydrazinylidene]methyl]benzoate

Systemtic Name: 4-[[2-[[4,5-bis(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoylhydrazinylidene]methyl]benzoate Openeye Name: 4-[[[2-[[4,5-bis(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]hydrazono]methyl]benzoate CAS Name: 4-[[[2-[[4,5-bis(4-methylphenyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]hydrazinylidene]methyl]benzoate IUPAC Name: 4-[[[2-[[4,5-bis(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]hydrazinylidene]methyl]benzoate Traditional Name: 4-[[[2-[[4,5-bis(p-tolyl)-1,2,4-triazol-3-yl]thio]acetyl]hydrazono]methyl]benzoate Formula: C26H22N5O3S- MolecularWeight: 484.54958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)C)SCC(=O)NN=CC4=CC=C(C=C4)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)C)SCC(=O)NN=CC4=CC=C(C=C4)C(=O)[O-]

InChI

InChI=1S/C26H23N5O3S/c1-17-3-9-20(10-4-17)24-29-30-26(31(24)22-13-5-18(2)6-14-22)35-16-23(32)28-27-15-19-7-11-21(12-8-19)25(33)34/h3-15H,16H2,1-2H3,(H,28,32)(H,33,34)/p-1