3-(4-methoxyphenyl)-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]propanamide

Systemtic Name: 3-(4-methoxyphenyl)-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]propanamide Openeye Name: 3-(4-methoxyphenyl)-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]propanamide CAS Name: 3-(4-methoxyphenyl)-N-[2-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]ethyl]propanamide IUPAC Name: 3-(4-methoxyphenyl)-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]propanamide Traditional Name: 3-(4-methoxyphenyl)-N-[2-[4-(2-pyrimidyl)piperazino]sulfonylethyl]propionamide Formula: C20H27N5O4S MolecularWeight: 433.52448

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27N5O4S/c1-29-18-6-3-17(4-7-18)5-8-19(26)21-11-16-30(27,28)25-14-12-24(13-15-25)20-22-9-2-10-23-20/h2-4,6-7,9-10H,5,8,11-16H2,1H3,(H,21,26)