2-[[2-(2-bromophenyl)carbonyl-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[[2-(2-bromophenyl)carbonyl-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[[2-(2-bromobenzoyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(p-tolyl)acetamide CAS Name: 2-[[2-[(2-bromophenyl)-oxomethyl]-5-phenyl-1,2,4-triazol-3-yl]thio]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[[2-(2-bromobenzoyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methylphenyl)acetamide Traditional Name: 2-[[2-(2-bromobenzoyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-N-(p-tolyl)acetamide Formula: C24H19BrN4O2S MolecularWeight: 507.40226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC2=NC(=NN2C(=O)C3=CC=CC=C3Br)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC2=NC(=NN2C(=O)C3=CC=CC=C3Br)C4=CC=CC=C4

InChI

InChI=1S/C24H19BrN4O2S/c1-16-11-13-18(14-12-16)26-21(30)15-32-24-27-22(17-7-3-2-4-8-17)28-29(24)23(31)19-9-5-6-10-20(19)25/h2-14H,15H2,1H3,(H,26,30)