2-(3,4-dimethoxyphenyl)-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]ethanamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]ethanamide Openeye Name: 2-(3,4-dimethoxyphenyl)-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]acetamide CAS Name: 2-(3,4-dimethoxyphenyl)-N-[2-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]ethyl]acetamide IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]acetamide Traditional Name: 2-(3,4-dimethoxyphenyl)-N-[2-[4-(2-pyrimidyl)piperazino]sulfonylethyl]acetamide Formula: C20H27N5O5S MolecularWeight: 449.52388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)NCCS(=O)(=O)N2CCN(CC2)C3=NC=CC=N3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)NCCS(=O)(=O)N2CCN(CC2)C3=NC=CC=N3)OC

InChI

InChI=1S/C20H27N5O5S/c1-29-17-5-4-16(14-18(17)30-2)15-19(26)21-8-13-31(27,28)25-11-9-24(10-12-25)20-22-6-3-7-23-20/h3-7,14H,8-13,15H2,1-2H3,(H,21,26)