1-[5-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]sulfonyl-2,3-dihydroindol-1-yl]ethanone

Systemtic Name: 1-[5-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]sulfonyl-2,3-dihydroindol-1-yl]ethanone Openeye Name: 1-[5-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]sulfonylindolin-1-yl]ethanone CAS Name: 1-[5-[[4-[6-(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperazinyl]sulfonyl]-2,3-dihydroindol-1-yl]ethanone IUPAC Name: 1-[5-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]sulfonyl-2,3-dihydroindol-1-yl]ethanone Traditional Name: 1-[5-[4-(6-pyrrolidinopyrimidin-4-yl)piperazino]sulfonylindolin-1-yl]ethanone Formula: C22H28N6O3S MolecularWeight: 456.56112

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C1C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=NC=NC(=C4)N5CCCC5

Isomeric SMILES

CC(=O)N1CCC2=C1C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=NC=NC(=C4)N5CCCC5

InChI

InChI=1S/C22H28N6O3S/c1-17(29)28-9-6-18-14-19(4-5-20(18)28)32(30,31)27-12-10-26(11-13-27)22-15-21(23-16-24-22)25-7-2-3-8-25/h4-5,14-16H,2-3,6-13H2,1H3