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

Systemtic Name: 1-[2-[(3-cyano-6,8-dimethyl-quinolin-2-yl)amino]ethyl]-1-(phenylmethyl)urea Openeye Name: 1-benzyl-1-[2-[(3-cyano-6,8-dimethyl-2-quinolyl)amino]ethyl]urea CAS Name: 1-[2-[(3-cyano-6,8-dimethyl-2-quinolinyl)amino]ethyl]-1-(phenylmethyl)urea IUPAC Name: 1-benzyl-1-[2-[(3-cyano-6,8-dimethylquinolin-2-yl)amino]ethyl]urea Traditional Name: 1-benzyl-1-[2-[(3-cyano-6,8-dimethyl-2-quinolyl)amino]ethyl]urea Formula: C22H23N5O MolecularWeight: 373.45092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C=C(C(=N2)NCCN(CC3=CC=CC=C3)C(=O)N)C#N)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C=C(C(=N2)NCCN(CC3=CC=CC=C3)C(=O)N)C#N)C

InChI

InChI=1S/C22H23N5O/c1-15-10-16(2)20-18(11-15)12-19(13-23)21(26-20)25-8-9-27(22(24)28)14-17-6-4-3-5-7-17/h3-7,10-12H,8-9,14H2,1-2H3,(H2,24,28)(H,25,26)