4-[2-[[4-(2,6-dimethylphenyl)-5-[3-(dimethylsulfamoyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzamide

Systemtic Name: 4-[2-[[4-(2,6-dimethylphenyl)-5-[3-(dimethylsulfamoyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzamide Openeye Name: 4-[[2-[[4-(2,6-dimethylphenyl)-5-[3-(dimethylsulfamoyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide CAS Name: 4-[[2-[[4-(2,6-dimethylphenyl)-5-[3-(dimethylsulfamoyl)phenyl]-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[[4-(2,6-dimethylphenyl)-5-[3-(dimethylsulfamoyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide Traditional Name: 4-[[2-[[4-(2,6-dimethylphenyl)-5-[3-(dimethylsulfamoyl)phenyl]-1,2,4-triazol-3-yl]thio]acetyl]amino]benzamide Formula: C27H28N6O4S2 MolecularWeight: 564.67902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)C(=O)N)C4=CC(=CC=C4)S(=O)(=O)N(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)C(=O)N)C4=CC(=CC=C4)S(=O)(=O)N(C)C

InChI

InChI=1S/C27H28N6O4S2/c1-17-7-5-8-18(2)24(17)33-26(20-9-6-10-22(15-20)39(36,37)32(3)4)30-31-27(33)38-16-23(34)29-21-13-11-19(12-14-21)25(28)35/h5-15H,16H2,1-4H3,(H2,28,35)(H,29,34)