N-(cyclohexylmethyl)-N-[(1-methylimidazol-2-yl)methyl]isoquinoline-1-carboxamide

Systemtic Name: N-(cyclohexylmethyl)-N-[(1-methylimidazol-2-yl)methyl]isoquinoline-1-carboxamide Openeye Name: N-(cyclohexylmethyl)-N-[(1-methylimidazol-2-yl)methyl]isoquinoline-1-carboxamide CAS Name: N-(cyclohexylmethyl)-N-[(1-methyl-2-imidazolyl)methyl]-1-isoquinolinecarboxamide IUPAC Name: N-(cyclohexylmethyl)-N-[(1-methylimidazol-2-yl)methyl]isoquinoline-1-carboxamide Traditional Name: N-(cyclohexylmethyl)-N-[(1-methylimidazol-2-yl)methyl]isoquinoline-1-carboxamide Formula: C22H26N4O MolecularWeight: 362.46804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1CN(CC2CCCCC2)C(=O)C3=NC=CC4=CC=CC=C43

Isomeric SMILES

CN1C=CN=C1CN(CC2CCCCC2)C(=O)C3=NC=CC4=CC=CC=C43

InChI

InChI=1S/C22H26N4O/c1-25-14-13-23-20(25)16-26(15-17-7-3-2-4-8-17)22(27)21-19-10-6-5-9-18(19)11-12-24-21/h5-6,9-14,17H,2-4,7-8,15-16H2,1H3