N-(2-azanylcyclohexyl)-3-(cyclopentylcarbonylamino)-4-[[methyl(phenethyl)amino]methyl]benzamide

Systemtic Name: N-(2-azanylcyclohexyl)-3-(cyclopentylcarbonylamino)-4-[[methyl(phenethyl)amino]methyl]benzamide Openeye Name: N-(2-aminocyclohexyl)-3-(cyclopentanecarbonylamino)-4-[[methyl(phenethyl)amino]methyl]benzamide CAS Name: N-(2-aminocyclohexyl)-3-[[cyclopentyl(oxo)methyl]amino]-4-[[methyl(phenethyl)amino]methyl]benzamide IUPAC Name: N-(2-aminocyclohexyl)-3-(cyclopentanecarbonylamino)-4-[[methyl(phenethyl)amino]methyl]benzamide Traditional Name: N-(2-aminocyclohexyl)-3-(cyclopentanecarbonylamino)-4-[[methyl(phenethyl)amino]methyl]benzamide Formula: C29H40N4O2 MolecularWeight: 476.6535

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)CC2=C(C=C(C=C2)C(=O)NC3CCCCC3N)NC(=O)C4CCCC4

Isomeric SMILES

CN(CCC1=CC=CC=C1)CC2=C(C=C(C=C2)C(=O)NC3CCCCC3N)NC(=O)C4CCCC4

InChI

InChI=1S/C29H40N4O2/c1-33(18-17-21-9-3-2-4-10-21)20-24-16-15-23(29(35)31-26-14-8-7-13-25(26)30)19-27(24)32-28(34)22-11-5-6-12-22/h2-4,9-10,15-16,19,22,25-26H,5-8,11-14,17-18,20,30H2,1H3,(H,31,35)(H,32,34)