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

Systemtic Name: N-cyclohexyl-5-(pentanoylamino)-2-[4-(phenylmethyl)piperazin-1-yl]benzamide Openeye Name: 2-(4-benzylpiperazin-1-yl)-N-cyclohexyl-5-(pentanoylamino)benzamide CAS Name: N-cyclohexyl-5-(1-oxopentylamino)-2-[4-(phenylmethyl)-1-piperazinyl]benzamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-N-cyclohexyl-5-(pentanoylamino)benzamide Traditional Name: 2-(4-benzylpiperazino)-N-cyclohexyl-5-(valerylamino)benzamide Formula: C29H40N4O2 MolecularWeight: 476.6535

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H40N4O2/c1-2-3-14-28(34)30-25-15-16-27(26(21-25)29(35)31-24-12-8-5-9-13-24)33-19-17-32(18-20-33)22-23-10-6-4-7-11-23/h4,6-7,10-11,15-16,21,24H,2-3,5,8-9,12-14,17-20,22H2,1H3,(H,30,34)(H,31,35)