N-(3-ethyl-2-morpholin-4-yl-pentyl)-4-(phenylsulfonyl)piperazine-1-carboxamide

Systemtic Name: N-(3-ethyl-2-morpholin-4-yl-pentyl)-4-(phenylsulfonyl)piperazine-1-carboxamide Openeye Name: 4-(benzenesulfonyl)-N-(3-ethyl-2-morpholino-pentyl)piperazine-1-carboxamide CAS Name: 4-(benzenesulfonyl)-N-[3-ethyl-2-(4-morpholinyl)pentyl]-1-piperazinecarboxamide IUPAC Name: 4-(benzenesulfonyl)-N-(3-ethyl-2-morpholin-4-ylpentyl)piperazine-1-carboxamide Traditional Name: 4-besyl-N-(3-ethyl-2-morpholino-pentyl)piperazine-1-carboxamide Formula: C22H36N4O4S MolecularWeight: 452.61064

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(CNC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2)N3CCOCC3

Isomeric SMILES

CCC(CC)C(CNC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2)N3CCOCC3

InChI

InChI=1S/C22H36N4O4S/c1-3-19(4-2)21(24-14-16-30-17-15-24)18-23-22(27)25-10-12-26(13-11-25)31(28,29)20-8-6-5-7-9-20/h5-9,19,21H,3-4,10-18H2,1-2H3,(H,23,27)