N-(2-azanylcyclohexyl)-3-[(4-tert-butylphenyl)carbonylamino]-4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]benzamide

Systemtic Name: N-(2-azanylcyclohexyl)-3-[(4-tert-butylphenyl)carbonylamino]-4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]benzamide Openeye Name: N-(2-aminocyclohexyl)-3-[(4-tert-butylbenzoyl)amino]-4-[[4-(2-pyridyl)piperazin-1-yl]methyl]benzamide CAS Name: N-(2-aminocyclohexyl)-3-[[(4-tert-butylphenyl)-oxomethyl]amino]-4-[[4-(2-pyridinyl)-1-piperazinyl]methyl]benzamide IUPAC Name: N-(2-aminocyclohexyl)-3-[(4-tert-butylbenzoyl)amino]-4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]benzamide Traditional Name: N-(2-aminocyclohexyl)-3-[(4-tert-butylbenzoyl)amino]-4-[[4-(2-pyridyl)piperazino]methyl]benzamide Formula: C34H44N6O2 MolecularWeight: 568.75216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)NC3CCCCC3N)CN4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)NC3CCCCC3N)CN4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C34H44N6O2/c1-34(2,3)27-15-13-24(14-16-27)32(41)38-30-22-25(33(42)37-29-9-5-4-8-28(29)35)11-12-26(30)23-39-18-20-40(21-19-39)31-10-6-7-17-36-31/h6-7,10-17,22,28-29H,4-5,8-9,18-21,23,35H2,1-3H3,(H,37,42)(H,38,41)