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

Systemtic Name: 2-[[2-(4-methylphenyl)carbonyl-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-nitrophenyl)ethanamide Openeye Name: 2-[[2-(4-methylbenzoyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-nitrophenyl)acetamide CAS Name: 2-[[2-[(4-methylphenyl)-oxomethyl]-5-phenyl-1,2,4-triazol-3-yl]thio]-N-(3-nitrophenyl)acetamide IUPAC Name: 2-[[2-(4-methylbenzoyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-nitrophenyl)acetamide Traditional Name: N-(3-nitrophenyl)-2-[(5-phenyl-2-p-toluoyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C24H19N5O4S MolecularWeight: 473.50376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2C(=NC(=N2)C3=CC=CC=C3)SCC(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2C(=NC(=N2)C3=CC=CC=C3)SCC(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H19N5O4S/c1-16-10-12-18(13-11-16)23(31)28-24(26-22(27-28)17-6-3-2-4-7-17)34-15-21(30)25-19-8-5-9-20(14-19)29(32)33/h2-14H,15H2,1H3,(H,25,30)