3-[(2-methoxyphenyl)-[2-(4-pyridin-3-ylsulfonylpiperazin-1-yl)ethanoyl]amino]propanamide

Systemtic Name: 3-[(2-methoxyphenyl)-[2-(4-pyridin-3-ylsulfonylpiperazin-1-yl)ethanoyl]amino]propanamide Openeye Name: 3-(2-methoxy-N-[2-[4-(3-pyridylsulfonyl)piperazin-1-yl]acetyl]anilino)propanamide CAS Name: 3-(2-methoxy-N-[1-oxo-2-[4-(3-pyridinylsulfonyl)-1-piperazinyl]ethyl]anilino)propanamide IUPAC Name: 3-(2-methoxy-N-[2-(4-pyridin-3-ylsulfonylpiperazin-1-yl)acetyl]anilino)propanamide Traditional Name: 3-(2-methoxy-N-[2-[4-(3-pyridylsulfonyl)piperazino]acetyl]anilino)propionamide Formula: C21H27N5O5S MolecularWeight: 461.53458

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N(CCC(=O)N)C(=O)CN2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

COC1=CC=CC=C1N(CCC(=O)N)C(=O)CN2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C21H27N5O5S/c1-31-19-7-3-2-6-18(19)26(10-8-20(22)27)21(28)16-24-11-13-25(14-12-24)32(29,30)17-5-4-9-23-15-17/h2-7,9,15H,8,10-14,16H2,1H3,(H2,22,27)