N-(2-morpholin-4-ylethyl)-5-(octylsulfonylamino)-2-[4-(phenylmethyl)piperidin-1-yl]benzamide

Systemtic Name: N-(2-morpholin-4-ylethyl)-5-(octylsulfonylamino)-2-[4-(phenylmethyl)piperidin-1-yl]benzamide Openeye Name: 2-(4-benzyl-1-piperidyl)-N-(2-morpholinoethyl)-5-(octylsulfonylamino)benzamide CAS Name: N-[2-(4-morpholinyl)ethyl]-5-(octylsulfonylamino)-2-[4-(phenylmethyl)-1-piperidinyl]benzamide IUPAC Name: 2-(4-benzylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)-5-(octylsulfonylamino)benzamide Traditional Name: 2-(4-benzylpiperidino)-N-(2-morpholinoethyl)-5-(octylsulfonylamino)benzamide Formula: C33H50N4O4S MolecularWeight: 598.8395

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)NC1=CC(=C(C=C1)N2CCC(CC2)CC3=CC=CC=C3)C(=O)NCCN4CCOCC4

Isomeric SMILES

CCCCCCCCS(=O)(=O)NC1=CC(=C(C=C1)N2CCC(CC2)CC3=CC=CC=C3)C(=O)NCCN4CCOCC4

InChI

InChI=1S/C33H50N4O4S/c1-2-3-4-5-6-10-25-42(39,40)35-30-13-14-32(31(27-30)33(38)34-17-20-36-21-23-41-24-22-36)37-18-15-29(16-19-37)26-28-11-8-7-9-12-28/h7-9,11-14,27,29,35H,2-6,10,15-26H2,1H3,(H,34,38)