1-(1-methylindol-3-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone

Systemtic Name: 1-(1-methylindol-3-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone Openeye Name: 1-(1-methylindol-3-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone CAS Name: 1-(1-methyl-3-indolyl)-2-(1H-1,2,4-triazol-5-ylthio)ethanone IUPAC Name: 1-(1-methylindol-3-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone Traditional Name: 1-(1-methylindol-3-yl)-2-(1H-1,2,4-triazol-5-ylthio)ethanone Formula: C13H12N4OS MolecularWeight: 272.32558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C(=O)CSC3=NC=NN3

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C(=O)CSC3=NC=NN3

InChI

InChI=1S/C13H12N4OS/c1-17-6-10(9-4-2-3-5-11(9)17)12(18)7-19-13-14-8-15-16-13/h2-6,8H,7H2,1H3,(H,14,15,16)