1-[2-[(3-cyano-6,8-dimethyl-quinolin-2-yl)amino]ethyl]-1-cyclohexyl-urea

Systemtic Name: 1-[2-[(3-cyano-6,8-dimethyl-quinolin-2-yl)amino]ethyl]-1-cyclohexyl-urea Openeye Name: 1-[2-[(3-cyano-6,8-dimethyl-2-quinolyl)amino]ethyl]-1-cyclohexyl-urea CAS Name: 1-[2-[(3-cyano-6,8-dimethyl-2-quinolinyl)amino]ethyl]-1-cyclohexylurea IUPAC Name: 1-[2-[(3-cyano-6,8-dimethylquinolin-2-yl)amino]ethyl]-1-cyclohexylurea Traditional Name: 1-[2-[(3-cyano-6,8-dimethyl-2-quinolyl)amino]ethyl]-1-cyclohexyl-urea Formula: C21H27N5O MolecularWeight: 365.47198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C=C(C(=N2)NCCN(C3CCCCC3)C(=O)N)C#N)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C=C(C(=N2)NCCN(C3CCCCC3)C(=O)N)C#N)C

InChI

InChI=1S/C21H27N5O/c1-14-10-15(2)19-16(11-14)12-17(13-22)20(25-19)24-8-9-26(21(23)27)18-6-4-3-5-7-18/h10-12,18H,3-9H2,1-2H3,(H2,23,27)(H,24,25)