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

Systemtic Name: 1-(1-ethylsulfonyl-2,3-dihydroindol-5-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone Openeye Name: 1-(1-ethylsulfonylindolin-5-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone CAS Name: 1-(1-ethylsulfonyl-2,3-dihydroindol-5-yl)-2-(1H-1,2,4-triazol-5-ylthio)ethanone IUPAC Name: 1-(1-ethylsulfonyl-2,3-dihydroindol-5-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone Traditional Name: 1-(1-esylindolin-5-yl)-2-(1H-1,2,4-triazol-5-ylthio)ethanone Formula: C14H16N4O3S2 MolecularWeight: 352.43184

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC2=C1C=CC(=C2)C(=O)CSC3=NC=NN3

Isomeric SMILES

CCS(=O)(=O)N1CCC2=C1C=CC(=C2)C(=O)CSC3=NC=NN3

InChI

InChI=1S/C14H16N4O3S2/c1-2-23(20,21)18-6-5-10-7-11(3-4-12(10)18)13(19)8-22-14-15-9-16-17-14/h3-4,7,9H,2,5-6,8H2,1H3,(H,15,16,17)