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

Systemtic Name: N-(2-azanylcyclohexyl)-3-(3-cyclopentylpropanoylamino)-4-[[methyl(phenethyl)amino]methyl]benzamide Openeye Name: N-(2-aminocyclohexyl)-3-(3-cyclopentylpropanoylamino)-4-[[methyl(phenethyl)amino]methyl]benzamide CAS Name: N-(2-aminocyclohexyl)-3-[(3-cyclopentyl-1-oxopropyl)amino]-4-[[methyl(phenethyl)amino]methyl]benzamide IUPAC Name: N-(2-aminocyclohexyl)-3-(3-cyclopentylpropanoylamino)-4-[[methyl(phenethyl)amino]methyl]benzamide Traditional Name: N-(2-aminocyclohexyl)-3-(3-cyclopentylpropanoylamino)-4-[[methyl(phenethyl)amino]methyl]benzamide Formula: C31H44N4O2 MolecularWeight: 504.70666

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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)CCC4CCCC4

Isomeric SMILES

CN(CCC1=CC=CC=C1)CC2=C(C=C(C=C2)C(=O)NC3CCCCC3N)NC(=O)CCC4CCCC4

InChI

InChI=1S/C31H44N4O2/c1-35(20-19-24-9-3-2-4-10-24)22-26-17-16-25(31(37)34-28-14-8-7-13-27(28)32)21-29(26)33-30(36)18-15-23-11-5-6-12-23/h2-4,9-10,16-17,21,23,27-28H,5-8,11-15,18-20,22,32H2,1H3,(H,33,36)(H,34,37)