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

Systemtic Name: N-cyclohexyl-5-(2-phenylmethoxyethanoylamino)-2-[4-(phenylmethyl)piperazin-1-yl]benzamide Openeye Name: 5-[(2-benzyloxyacetyl)amino]-2-(4-benzylpiperazin-1-yl)-N-cyclohexyl-benzamide CAS Name: N-cyclohexyl-5-[(1-oxo-2-phenylmethoxyethyl)amino]-2-[4-(phenylmethyl)-1-piperazinyl]benzamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-N-cyclohexyl-5-[(2-phenylmethoxyacetyl)amino]benzamide Traditional Name: 5-[(2-benzoxyacetyl)amino]-2-(4-benzylpiperazino)-N-cyclohexyl-benzamide Formula: C33H40N4O3 MolecularWeight: 540.6957

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=C(C=CC(=C2)NC(=O)COCC3=CC=CC=C3)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=C(C=CC(=C2)NC(=O)COCC3=CC=CC=C3)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C33H40N4O3/c38-32(25-40-24-27-12-6-2-7-13-27)34-29-16-17-31(30(22-29)33(39)35-28-14-8-3-9-15-28)37-20-18-36(19-21-37)23-26-10-4-1-5-11-26/h1-2,4-7,10-13,16-17,22,28H,3,8-9,14-15,18-21,23-25H2,(H,34,38)(H,35,39)