1-(2,3-dihydroindol-1-yl)-2-[2-[4-(phenylmethyl)piperazin-1-yl]carbonylphenyl]sulfanyl-ethanone

Systemtic Name: 1-(2,3-dihydroindol-1-yl)-2-[2-[4-(phenylmethyl)piperazin-1-yl]carbonylphenyl]sulfanyl-ethanone Openeye Name: 2-[2-(4-benzylpiperazine-1-carbonyl)phenyl]sulfanyl-1-indolin-1-yl-ethanone CAS Name: 1-(2,3-dihydroindol-1-yl)-2-[[2-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]phenyl]thio]ethanone IUPAC Name: 2-[2-(4-benzylpiperazine-1-carbonyl)phenyl]sulfanyl-1-(2,3-dihydroindol-1-yl)ethanone Traditional Name: 2-[[2-(4-benzylpiperazine-1-carbonyl)phenyl]thio]-1-indolin-1-yl-ethanone Formula: C28H29N3O2S MolecularWeight: 471.61376

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)C(=O)CSC3=CC=CC=C3C(=O)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(C2=CC=CC=C21)C(=O)CSC3=CC=CC=C3C(=O)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C28H29N3O2S/c32-27(31-15-14-23-10-4-6-12-25(23)31)21-34-26-13-7-5-11-24(26)28(33)30-18-16-29(17-19-30)20-22-8-2-1-3-9-22/h1-13H,14-21H2