N-[2-(1-methylpyrrol-2-yl)-2-morpholin-4-yl-ethyl]-3-(phenylsulfonyl)propanamide

Systemtic Name: N-[2-(1-methylpyrrol-2-yl)-2-morpholin-4-yl-ethyl]-3-(phenylsulfonyl)propanamide Openeye Name: 3-(benzenesulfonyl)-N-[2-(1-methylpyrrol-2-yl)-2-morpholino-ethyl]propanamide CAS Name: 3-(benzenesulfonyl)-N-[2-(1-methyl-2-pyrrolyl)-2-(4-morpholinyl)ethyl]propanamide IUPAC Name: 3-(benzenesulfonyl)-N-[2-(1-methylpyrrol-2-yl)-2-morpholin-4-ylethyl]propanamide Traditional Name: 3-besyl-N-[2-(1-methylpyrrol-2-yl)-2-morpholino-ethyl]propionamide Formula: C20H27N3O4S MolecularWeight: 405.51108

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(CNC(=O)CCS(=O)(=O)C2=CC=CC=C2)N3CCOCC3

Isomeric SMILES

CN1C=CC=C1C(CNC(=O)CCS(=O)(=O)C2=CC=CC=C2)N3CCOCC3

InChI

InChI=1S/C20H27N3O4S/c1-22-10-5-8-18(22)19(23-11-13-27-14-12-23)16-21-20(24)9-15-28(25,26)17-6-3-2-4-7-17/h2-8,10,19H,9,11-16H2,1H3,(H,21,24)