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

Systemtic Name: N-cyclohexyl-5-(2-ethylhexanoylamino)-2-[4-(phenylmethyl)piperazin-1-yl]benzamide Openeye Name: 2-(4-benzylpiperazin-1-yl)-N-cyclohexyl-5-(2-ethylhexanoylamino)benzamide CAS Name: N-cyclohexyl-5-[(2-ethyl-1-oxohexyl)amino]-2-[4-(phenylmethyl)-1-piperazinyl]benzamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-N-cyclohexyl-5-(2-ethylhexanoylamino)benzamide Traditional Name: 2-(4-benzylpiperazino)-N-cyclohexyl-5-(2-ethylhexanoylamino)benzamide Formula: C32H46N4O2 MolecularWeight: 518.73324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H46N4O2/c1-3-5-14-26(4-2)31(37)34-28-17-18-30(29(23-28)32(38)33-27-15-10-7-11-16-27)36-21-19-35(20-22-36)24-25-12-8-6-9-13-25/h6,8-9,12-13,17-18,23,26-27H,3-5,7,10-11,14-16,19-22,24H2,1-2H3,(H,33,38)(H,34,37)