1-[(4-methylphenyl)carbamoylamino]-N-(pyridin-3-ylmethyl)cyclohexane-1-carboxamide

Systemtic Name: 1-[(4-methylphenyl)carbamoylamino]-N-(pyridin-3-ylmethyl)cyclohexane-1-carboxamide Openeye Name: 1-(p-tolylcarbamoylamino)-N-(3-pyridylmethyl)cyclohexanecarboxamide CAS Name: 1-[[(4-methylanilino)-oxomethyl]amino]-N-(3-pyridinylmethyl)-1-cyclohexanecarboxamide IUPAC Name: 1-[(4-methylphenyl)carbamoylamino]-N-(pyridin-3-ylmethyl)cyclohexane-1-carboxamide Traditional Name: 1-(p-tolylcarbamoylamino)-N-(3-pyridylmethyl)cyclohexanecarboxamide Formula: C21H26N4O2 MolecularWeight: 366.45674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NC2(CCCCC2)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NC2(CCCCC2)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C21H26N4O2/c1-16-7-9-18(10-8-16)24-20(27)25-21(11-3-2-4-12-21)19(26)23-15-17-6-5-13-22-14-17/h5-10,13-14H,2-4,11-12,15H2,1H3,(H,23,26)(H2,24,25,27)