3-methoxy-4-prop-2-enoxy-N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]benzamide

Systemtic Name: 3-methoxy-4-prop-2-enoxy-N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]benzamide Openeye Name: 4-allyloxy-3-methoxy-N-[2-[4-(2-pyridyl)piperazin-1-yl]sulfonylethyl]benzamide CAS Name: 3-methoxy-4-prop-2-enoxy-N-[2-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]ethyl]benzamide IUPAC Name: 3-methoxy-4-prop-2-enoxy-N-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]benzamide Traditional Name: 4-allyloxy-3-methoxy-N-[2-[4-(2-pyridyl)piperazino]sulfonylethyl]benzamide Formula: C22H28N4O5S MolecularWeight: 460.54652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N4O5S/c1-3-15-31-19-8-7-18(17-20(19)30-2)22(27)24-10-16-32(28,29)26-13-11-25(12-14-26)21-6-4-5-9-23-21/h3-9,17H,1,10-16H2,2H3,(H,24,27)