1-[2-methyl-5-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-2,3-dihydroindol-1-yl]propan-1-one

Systemtic Name: 1-[2-methyl-5-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-2,3-dihydroindol-1-yl]propan-1-one Openeye Name: 1-[2-methyl-5-[4-(2-pyridyl)piperazin-1-yl]sulfonyl-indolin-1-yl]propan-1-one CAS Name: 1-[2-methyl-5-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]-2,3-dihydroindol-1-yl]-1-propanone IUPAC Name: 1-[2-methyl-5-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-2,3-dihydroindol-1-yl]propan-1-one Traditional Name: 1-[2-methyl-5-[4-(2-pyridyl)piperazino]sulfonyl-indolin-1-yl]propan-1-one Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(CC2=C1C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=N4)C

Isomeric SMILES

CCC(=O)N1C(CC2=C1C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=N4)C

InChI

InChI=1S/C21H26N4O3S/c1-3-21(26)25-16(2)14-17-15-18(7-8-19(17)25)29(27,28)24-12-10-23(11-13-24)20-6-4-5-9-22-20/h4-9,15-16H,3,10-14H2,1-2H3