1-[5-[4-(2-phenylsulfanylethyl)piperazin-1-yl]carbonyl-2,3-dihydroindol-1-yl]ethanone

Systemtic Name: 1-[5-[4-(2-phenylsulfanylethyl)piperazin-1-yl]carbonyl-2,3-dihydroindol-1-yl]ethanone Openeye Name: 1-[5-[4-(2-phenylsulfanylethyl)piperazine-1-carbonyl]indolin-1-yl]ethanone CAS Name: 1-[5-[oxo-[4-[2-(phenylthio)ethyl]-1-piperazinyl]methyl]-2,3-dihydroindol-1-yl]ethanone IUPAC Name: 1-[5-[4-(2-phenylsulfanylethyl)piperazine-1-carbonyl]-2,3-dihydroindol-1-yl]ethanone Traditional Name: 1-[5-[4-[2-(phenylthio)ethyl]piperazine-1-carbonyl]indolin-1-yl]ethanone Formula: C23H27N3O2S MolecularWeight: 409.54438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C1C=CC(=C2)C(=O)N3CCN(CC3)CCSC4=CC=CC=C4

Isomeric SMILES

CC(=O)N1CCC2=C1C=CC(=C2)C(=O)N3CCN(CC3)CCSC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O2S/c1-18(27)26-10-9-19-17-20(7-8-22(19)26)23(28)25-13-11-24(12-14-25)15-16-29-21-5-3-2-4-6-21/h2-8,17H,9-16H2,1H3