6-ethyl-2-[3-[[2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl]amino]phenyl]-1H-pyrimidin-4-one

Systemtic Name: 6-ethyl-2-[3-[[2-oxidanylidene-2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl]amino]phenyl]-1H-pyrimidin-4-one Openeye Name: 2-[3-[[2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxo-ethyl]amino]phenyl]-6-ethyl-1H-pyrimidin-4-one CAS Name: 2-[3-[[2-[4-(benzenesulfonyl)-1-piperazinyl]-2-oxoethyl]amino]phenyl]-6-ethyl-1H-pyrimidin-4-one IUPAC Name: 2-[3-[[2-[4-(benzenesulfonyl)piperazin-1-yl]-2-oxoethyl]amino]phenyl]-6-ethyl-1H-pyrimidin-4-one Traditional Name: 2-[3-[[2-(4-besylpiperazino)-2-keto-ethyl]amino]phenyl]-6-ethyl-1H-pyrimidin-4-one Formula: C24H27N5O4S MolecularWeight: 481.56728

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)N=C(N1)C2=CC(=CC=C2)NCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC(=O)N=C(N1)C2=CC(=CC=C2)NCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H27N5O4S/c1-2-19-16-22(30)27-24(26-19)18-7-6-8-20(15-18)25-17-23(31)28-11-13-29(14-12-28)34(32,33)21-9-4-3-5-10-21/h3-10,15-16,25H,2,11-14,17H2,1H3,(H,26,27,30)