1-[(2,6-dimethylphenyl)carbamoylamino]-N-(3-imidazol-1-ylpropyl)cyclohexane-1-carboxamide

Systemtic Name: 1-[(2,6-dimethylphenyl)carbamoylamino]-N-(3-imidazol-1-ylpropyl)cyclohexane-1-carboxamide Openeye Name: 1-[(2,6-dimethylphenyl)carbamoylamino]-N-(3-imidazol-1-ylpropyl)cyclohexanecarboxamide CAS Name: 1-[[(2,6-dimethylanilino)-oxomethyl]amino]-N-[3-(1-imidazolyl)propyl]-1-cyclohexanecarboxamide IUPAC Name: 1-[(2,6-dimethylphenyl)carbamoylamino]-N-(3-imidazol-1-ylpropyl)cyclohexane-1-carboxamide Traditional Name: 1-[(2,6-dimethylphenyl)carbamoylamino]-N-(3-imidazol-1-ylpropyl)cyclohexanecarboxamide Formula: C22H31N5O2 MolecularWeight: 397.51384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)NC2(CCCCC2)C(=O)NCCCN3C=CN=C3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)NC2(CCCCC2)C(=O)NCCCN3C=CN=C3

InChI

InChI=1S/C22H31N5O2/c1-17-8-6-9-18(2)19(17)25-21(29)26-22(10-4-3-5-11-22)20(28)24-12-7-14-27-15-13-23-16-27/h6,8-9,13,15-16H,3-5,7,10-12,14H2,1-2H3,(H,24,28)(H2,25,26,29)