2-[3,3-dimethyl-5-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-2H-indol-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[3,3-dimethyl-5-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-2H-indol-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[3,3-dimethyl-5-[4-(2-pyridyl)piperazin-1-yl]sulfonyl-indolin-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[3,3-dimethyl-5-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]-2H-indol-1-yl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[3,3-dimethyl-5-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-2H-indol-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[3,3-dimethyl-5-[4-(2-pyridyl)piperazino]sulfonyl-indolin-1-yl]-1-pyrrolidino-ethanone Formula: C25H33N5O3S MolecularWeight: 483.62622

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C2=C1C=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=N4)CC(=O)N5CCCC5)C

Isomeric SMILES

CC1(CN(C2=C1C=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=N4)CC(=O)N5CCCC5)C

InChI

InChI=1S/C25H33N5O3S/c1-25(2)19-29(18-24(31)28-11-5-6-12-28)22-9-8-20(17-21(22)25)34(32,33)30-15-13-27(14-16-30)23-7-3-4-10-26-23/h3-4,7-10,17H,5-6,11-16,18-19H2,1-2H3