2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(1-methyl-2-phenyl-indol-3-yl)ethanone

Systemtic Name: 2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(1-methyl-2-phenyl-indol-3-yl)ethanone Openeye Name: 2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(1-methyl-2-phenyl-indol-3-yl)ethanone CAS Name: 2-[(5-ethyl-1H-1,2,4-triazol-3-yl)thio]-1-(1-methyl-2-phenyl-3-indolyl)ethanone IUPAC Name: 2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(1-methyl-2-phenylindol-3-yl)ethanone Traditional Name: 2-[(5-ethyl-1H-1,2,4-triazol-3-yl)thio]-1-(1-methyl-2-phenyl-indol-3-yl)ethanone Formula: C21H20N4OS MolecularWeight: 376.4747

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NN1)SCC(=O)C2=C(N(C3=CC=CC=C32)C)C4=CC=CC=C4

Isomeric SMILES

CCC1=NC(=NN1)SCC(=O)C2=C(N(C3=CC=CC=C32)C)C4=CC=CC=C4

InChI

InChI=1S/C21H20N4OS/c1-3-18-22-21(24-23-18)27-13-17(26)19-15-11-7-8-12-16(15)25(2)20(19)14-9-5-4-6-10-14/h4-12H,3,13H2,1-2H3,(H,22,23,24)