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

Systemtic Name: N-(4-methyl-3-nitro-phenyl)-2-[[2-(2-methylphenyl)carbonyl-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[2-(2-methylbenzoyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-3-nitro-phenyl)acetamide CAS Name: N-(4-methyl-3-nitrophenyl)-2-[[2-[(2-methylphenyl)-oxomethyl]-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[2-(2-methylbenzoyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-3-nitrophenyl)acetamide Traditional Name: N-(4-methyl-3-nitro-phenyl)-2-[[2-o-toluoyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C24H20N6O4S MolecularWeight: 488.5184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NC(=NN2C(=O)C3=CC=CC=C3C)C4=CC=NC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NC(=NN2C(=O)C3=CC=CC=C3C)C4=CC=NC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H20N6O4S/c1-15-5-3-4-6-19(15)23(32)29-24(27-22(28-29)17-9-11-25-12-10-17)35-14-21(31)26-18-8-7-16(2)20(13-18)30(33)34/h3-13H,14H2,1-2H3,(H,26,31)