1-[6-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-3,4-dihydro-2H-quinolin-1-yl]propan-1-one

Systemtic Name: 1-[6-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-3,4-dihydro-2H-quinolin-1-yl]propan-1-one Openeye Name: 1-[6-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-3,4-dihydro-2H-quinolin-1-yl]propan-1-one CAS Name: 1-[6-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]-3,4-dihydro-2H-quinolin-1-yl]-1-propanone IUPAC Name: 1-[6-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-3,4-dihydro-2H-quinolin-1-yl]propan-1-one Traditional Name: 1-[6-[4-(2-pyrimidyl)piperazino]sulfonyl-3,4-dihydro-2H-quinolin-1-yl]propan-1-one Formula: C20H25N5O3S MolecularWeight: 415.5092

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CCC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C20H25N5O3S/c1-2-19(26)25-10-3-5-16-15-17(6-7-18(16)25)29(27,28)24-13-11-23(12-14-24)20-21-8-4-9-22-20/h4,6-9,15H,2-3,5,10-14H2,1H3