1-(3-chlorophenyl)-3-[3-[(3-cyano-6-methoxy-quinolin-2-yl)amino]propyl]urea

Systemtic Name: 1-(3-chlorophenyl)-3-[3-[(3-cyano-6-methoxy-quinolin-2-yl)amino]propyl]urea Openeye Name: 1-(3-chlorophenyl)-3-[3-[(3-cyano-6-methoxy-2-quinolyl)amino]propyl]urea CAS Name: 1-(3-chlorophenyl)-3-[3-[(3-cyano-6-methoxy-2-quinolinyl)amino]propyl]urea IUPAC Name: 1-(3-chlorophenyl)-3-[3-[(3-cyano-6-methoxyquinolin-2-yl)amino]propyl]urea Traditional Name: 1-(3-chlorophenyl)-3-[3-[(3-cyano-6-methoxy-2-quinolyl)amino]propyl]urea Formula: C21H20ClN5O2 MolecularWeight: 409.8688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(C(=C2)C#N)NCCCNC(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(C(=C2)C#N)NCCCNC(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H20ClN5O2/c1-29-18-6-7-19-14(11-18)10-15(13-23)20(27-19)24-8-3-9-25-21(28)26-17-5-2-4-16(22)12-17/h2,4-7,10-12H,3,8-9H2,1H3,(H,24,27)(H2,25,26,28)