N-(2-azanylcyclohexyl)-3-[(3,4-dimethoxyphenyl)carbonylamino]-4-[(4-ethanoylpiperazin-1-yl)methyl]benzamide

Systemtic Name: N-(2-azanylcyclohexyl)-3-[(3,4-dimethoxyphenyl)carbonylamino]-4-[(4-ethanoylpiperazin-1-yl)methyl]benzamide Openeye Name: 4-[(4-acetylpiperazin-1-yl)methyl]-N-(2-aminocyclohexyl)-3-[(3,4-dimethoxybenzoyl)amino]benzamide CAS Name: 4-[(4-acetyl-1-piperazinyl)methyl]-N-(2-aminocyclohexyl)-3-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]benzamide IUPAC Name: 4-[(4-acetylpiperazin-1-yl)methyl]-N-(2-aminocyclohexyl)-3-[(3,4-dimethoxybenzoyl)amino]benzamide Traditional Name: 4-[(4-acetylpiperazino)methyl]-N-(2-aminocyclohexyl)-3-(veratroylamino)benzamide Formula: C29H39N5O5 MolecularWeight: 537.65046

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)CC2=C(C=C(C=C2)C(=O)NC3CCCCC3N)NC(=O)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC(=O)N1CCN(CC1)CC2=C(C=C(C=C2)C(=O)NC3CCCCC3N)NC(=O)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C29H39N5O5/c1-19(35)34-14-12-33(13-15-34)18-22-9-8-20(28(36)31-24-7-5-4-6-23(24)30)16-25(22)32-29(37)21-10-11-26(38-2)27(17-21)39-3/h8-11,16-17,23-24H,4-7,12-15,18,30H2,1-3H3,(H,31,36)(H,32,37)