N-butyl-2-[[5-methyl-4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-butyl-2-[[5-methyl-4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole-4-carboxamide Openeye Name: N-butyl-2-[[5-methyl-4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]thiazole-4-carboxamide CAS Name: N-butyl-2-[[[5-methyl-4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]methyl]-4-thiazolecarboxamide IUPAC Name: N-butyl-2-[[5-methyl-4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole-4-carboxamide Traditional Name: N-butyl-2-[[[5-methyl-4-(o-tolyl)-1,2,4-triazol-3-yl]thio]methyl]thiazole-4-carboxamide Formula: C19H23N5OS2 MolecularWeight: 401.54882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CSC(=N1)CSC2=NN=C(N2C3=CC=CC=C3C)C

Isomeric SMILES

CCCCNC(=O)C1=CSC(=N1)CSC2=NN=C(N2C3=CC=CC=C3C)C

InChI

InChI=1S/C19H23N5OS2/c1-4-5-10-20-18(25)15-11-26-17(21-15)12-27-19-23-22-14(3)24(19)16-9-7-6-8-13(16)2/h6-9,11H,4-5,10,12H2,1-3H3,(H,20,25)