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

Systemtic Name: 2-[3,3-dimethyl-5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-2H-indol-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[3,3-dimethyl-5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-indolin-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[3,3-dimethyl-5-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]-2H-indol-1-yl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[3,3-dimethyl-5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-2H-indol-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[3,3-dimethyl-5-[4-(2-pyrimidyl)piperazino]sulfonyl-indolin-1-yl]-1-pyrrolidino-ethanone Formula: C24H32N6O3S MolecularWeight: 484.61428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H32N6O3S/c1-24(2)18-29(17-22(31)27-10-3-4-11-27)21-7-6-19(16-20(21)24)34(32,33)30-14-12-28(13-15-30)23-25-8-5-9-26-23/h5-9,16H,3-4,10-15,17-18H2,1-2H3