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

Systemtic Name: 2-[3-(4-methylphenyl)-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-(2-nitrophenyl)ethanamide Openeye Name: N-(2-nitrophenyl)-2-[4-phenyl-3-(p-tolyl)-5-thioxo-1,2,4-triazol-1-yl]acetamide CAS Name: 2-[3-(4-methylphenyl)-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-(2-nitrophenyl)acetamide IUPAC Name: 2-[3-(4-methylphenyl)-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-(2-nitrophenyl)acetamide Traditional Name: N-(2-nitrophenyl)-2-[4-phenyl-3-(p-tolyl)-5-thioxo-1,2,4-triazol-1-yl]acetamide Formula: C23H19N5O3S MolecularWeight: 445.49366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=S)N2C3=CC=CC=C3)CC(=O)NC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=S)N2C3=CC=CC=C3)CC(=O)NC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C23H19N5O3S/c1-16-11-13-17(14-12-16)22-25-26(23(32)27(22)18-7-3-2-4-8-18)15-21(29)24-19-9-5-6-10-20(19)28(30)31/h2-14H,15H2,1H3,(H,24,29)