1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-3-pyridin-4-yl-propan-1-one

Systemtic Name: 1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-3-pyridin-4-yl-propan-1-one Openeye Name: 1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-3-(4-pyridyl)propan-1-one CAS Name: 1-[4-(2,5-dimethoxyphenyl)sulfonyl-1-piperazinyl]-3-pyridin-4-yl-1-propanone IUPAC Name: 1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-3-pyridin-4-ylpropan-1-one Traditional Name: 1-[4-(2,5-dimethoxyphenyl)sulfonylpiperazino]-3-(4-pyridyl)propan-1-one Formula: C20H25N3O5S MolecularWeight: 419.4946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=CC=NC=C3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=CC=NC=C3

InChI

InChI=1S/C20H25N3O5S/c1-27-17-4-5-18(28-2)19(15-17)29(25,26)23-13-11-22(12-14-23)20(24)6-3-16-7-9-21-10-8-16/h4-5,7-10,15H,3,6,11-14H2,1-2H3