2-[methyl-[[3-methyl-4-(2-methylphenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]amino]-N-propyl-ethanamide

Systemtic Name: 2-[methyl-[[3-methyl-4-(2-methylphenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]amino]-N-propyl-ethanamide Openeye Name: 2-[methyl-[[3-methyl-4-(o-tolyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]amino]-N-propyl-acetamide CAS Name: 2-[methyl-[[3-methyl-4-(2-methylphenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]amino]-N-propylacetamide IUPAC Name: 2-[methyl-[[3-methyl-4-(2-methylphenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]amino]-N-propylacetamide Traditional Name: 2-[methyl-[[3-methyl-4-(o-tolyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]amino]-N-propyl-acetamide Formula: C17H25N5OS MolecularWeight: 347.4783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN(C)CN1C(=S)N(C(=N1)C)C2=CC=CC=C2C

Isomeric SMILES

CCCNC(=O)CN(C)CN1C(=S)N(C(=N1)C)C2=CC=CC=C2C

InChI

InChI=1S/C17H25N5OS/c1-5-10-18-16(23)11-20(4)12-21-17(24)22(14(3)19-21)15-9-7-6-8-13(15)2/h6-9H,5,10-12H2,1-4H3,(H,18,23)