N-[(2,4-dimethylphenyl)methyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-[(2,4-dimethylphenyl)methyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-[(2,4-dimethylphenyl)methyl]-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-[(2,4-dimethylphenyl)methyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-[(2,4-dimethylphenyl)methyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-(2,4-dimethylbenzyl)-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C17H18N4OS2 MolecularWeight: 358.48102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CNC(=O)CN2C(=NNC2=S)C3=CC=CS3)C

Isomeric SMILES

CC1=CC(=C(C=C1)CNC(=O)CN2C(=NNC2=S)C3=CC=CS3)C

InChI

InChI=1S/C17H18N4OS2/c1-11-5-6-13(12(2)8-11)9-18-15(22)10-21-16(19-20-17(21)23)14-4-3-7-24-14/h3-8H,9-10H2,1-2H3,(H,18,22)(H,20,23)