N-cyclohexyl-2-[4-(phenylmethyl)piperazin-1-yl]-5-(propanoylamino)benzamide

Systemtic Name: N-cyclohexyl-2-[4-(phenylmethyl)piperazin-1-yl]-5-(propanoylamino)benzamide Openeye Name: 2-(4-benzylpiperazin-1-yl)-N-cyclohexyl-5-(propanoylamino)benzamide CAS Name: N-cyclohexyl-5-(1-oxopropylamino)-2-[4-(phenylmethyl)-1-piperazinyl]benzamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-N-cyclohexyl-5-(propanoylamino)benzamide Traditional Name: 2-(4-benzylpiperazino)-N-cyclohexyl-5-propionamido-benzamide Formula: C27H36N4O2 MolecularWeight: 448.60034

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)CC3=CC=CC=C3)C(=O)NC4CCCCC4

Isomeric SMILES

CCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)CC3=CC=CC=C3)C(=O)NC4CCCCC4

InChI

InChI=1S/C27H36N4O2/c1-2-26(32)28-23-13-14-25(24(19-23)27(33)29-22-11-7-4-8-12-22)31-17-15-30(16-18-31)20-21-9-5-3-6-10-21/h3,5-6,9-10,13-14,19,22H,2,4,7-8,11-12,15-18,20H2,1H3,(H,28,32)(H,29,33)