2-(2,3-dihydroindol-1-yl)-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(2,3-dihydroindol-1-yl)-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-indolin-1-yl-ethanone CAS Name: 2-(2,3-dihydroindol-1-yl)-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-(2,3-dihydroindol-1-yl)ethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-indolin-1-yl-ethanone Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)CC(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(C2=CC=CC=C21)CC(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C21H25N3O3S/c25-21(16-23-11-10-19-8-4-5-9-20(19)23)22-12-14-24(15-13-22)28(26,27)17-18-6-2-1-3-7-18/h1-9H,10-17H2