1-(2,3-dihydroindol-1-yl)-2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one

Systemtic Name: 1-(2,3-dihydroindol-1-yl)-2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Openeye Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-1-indolin-1-yl-propan-1-one CAS Name: 1-(2,3-dihydroindol-1-yl)-2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-1-propanone IUPAC Name: 1-(2,3-dihydroindol-1-yl)-2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Traditional Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-1-indolin-1-yl-propan-1-one Formula: C25H22N4OS MolecularWeight: 426.53338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC=CC=C21)SC3=NN=C(N3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C(=O)N1CCC2=CC=CC=C21)SC3=NN=C(N3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H22N4OS/c1-18(24(30)28-17-16-19-10-8-9-15-22(19)28)31-25-27-26-23(20-11-4-2-5-12-20)29(25)21-13-6-3-7-14-21/h2-15,18H,16-17H2,1H3