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

Systemtic Name: 2-[4-(2,5-dimethylphenyl)-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-(2,5-dimethylphenyl)-3-phenyl-5-thioxo-1,2,4-triazol-1-yl]acetamide CAS Name: 2-[4-(2,5-dimethylphenyl)-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(2,5-dimethylphenyl)-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]acetamide Traditional Name: N-benzyl-2-[4-(2,5-dimethylphenyl)-3-phenyl-5-thioxo-1,2,4-triazol-1-yl]acetamide Formula: C25H24N4OS MolecularWeight: 428.54926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=NN(C2=S)CC(=O)NCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=NN(C2=S)CC(=O)NCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H24N4OS/c1-18-13-14-19(2)22(15-18)29-24(21-11-7-4-8-12-21)27-28(25(29)31)17-23(30)26-16-20-9-5-3-6-10-20/h3-15H,16-17H2,1-2H3,(H,26,30)