1-(2,3-dihydroindol-1-yl)-4-[4-(phenylsulfonyl)piperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(2,3-dihydroindol-1-yl)-4-[4-(phenylsulfonyl)piperazin-1-yl]butane-1,4-dione Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-4-indolin-1-yl-butane-1,4-dione CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-4-(2,3-dihydroindol-1-yl)butane-1,4-dione IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-4-(2,3-dihydroindol-1-yl)butane-1,4-dione Traditional Name: 1-(4-besylpiperazino)-4-indolin-1-yl-butane-1,4-dione Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O4S/c26-21(10-11-22(27)25-13-12-18-6-4-5-9-20(18)25)23-14-16-24(17-15-23)30(28,29)19-7-2-1-3-8-19/h1-9H,10-17H2