1-(7-ethyl-1H-indol-3-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(7-ethyl-1H-indol-3-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(7-ethyl-1H-indol-3-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanone CAS Name: 1-(7-ethyl-1H-indol-3-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-(7-ethyl-1H-indol-3-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(7-ethyl-1H-indol-3-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]ethanone Formula: C20H18N4OS MolecularWeight: 362.44812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)CSC3=NN=CN3C4=CC=CC=C4

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)CSC3=NN=CN3C4=CC=CC=C4

InChI

InChI=1S/C20H18N4OS/c1-2-14-7-6-10-16-17(11-21-19(14)16)18(25)12-26-20-23-22-13-24(20)15-8-4-3-5-9-15/h3-11,13,21H,2,12H2,1H3