5-(butylcarbamoylamino)-N-(3-morpholin-4-ylpropyl)-2-[4-(phenylmethyl)piperidin-1-yl]benzamide

Systemtic Name: 5-(butylcarbamoylamino)-N-(3-morpholin-4-ylpropyl)-2-[4-(phenylmethyl)piperidin-1-yl]benzamide Openeye Name: 2-(4-benzyl-1-piperidyl)-5-(butylcarbamoylamino)-N-(3-morpholinopropyl)benzamide CAS Name: 5-[[butylamino(oxo)methyl]amino]-N-[3-(4-morpholinyl)propyl]-2-[4-(phenylmethyl)-1-piperidinyl]benzamide IUPAC Name: 2-(4-benzylpiperidin-1-yl)-5-(butylcarbamoylamino)-N-(3-morpholin-4-ylpropyl)benzamide Traditional Name: 2-(4-benzylpiperidino)-5-(butylcarbamoylamino)-N-(3-morpholinopropyl)benzamide Formula: C31H45N5O3 MolecularWeight: 535.7207

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=CC(=C(C=C1)N2CCC(CC2)CC3=CC=CC=C3)C(=O)NCCCN4CCOCC4

Isomeric SMILES

CCCCNC(=O)NC1=CC(=C(C=C1)N2CCC(CC2)CC3=CC=CC=C3)C(=O)NCCCN4CCOCC4

InChI

InChI=1S/C31H45N5O3/c1-2-3-14-33-31(38)34-27-10-11-29(36-17-12-26(13-18-36)23-25-8-5-4-6-9-25)28(24-27)30(37)32-15-7-16-35-19-21-39-22-20-35/h4-6,8-11,24,26H,2-3,7,12-23H2,1H3,(H,32,37)(H2,33,34,38)