4-[(3-chloranyl-4-imidazol-1-yl-phenyl)amino]-6-methoxy-7-(3-morpholin-4-ylpropoxy)quinoline-3-carbonitrile

Systemtic Name: 4-[(3-chloranyl-4-imidazol-1-yl-phenyl)amino]-6-methoxy-7-(3-morpholin-4-ylpropoxy)quinoline-3-carbonitrile Openeye Name: 4-(3-chloro-4-imidazol-1-yl-anilino)-6-methoxy-7-(3-morpholinopropoxy)quinoline-3-carbonitrile CAS Name: 4-[3-chloro-4-(1-imidazolyl)anilino]-6-methoxy-7-[3-(4-morpholinyl)propoxy]-3-quinolinecarbonitrile IUPAC Name: 4-(3-chloro-4-imidazol-1-ylanilino)-6-methoxy-7-(3-morpholin-4-ylpropoxy)quinoline-3-carbonitrile Traditional Name: 4-(3-chloro-4-imidazol-1-yl-anilino)-6-methoxy-7-(3-morpholinopropoxy)quinoline-3-carbonitrile Formula: C27H27ClN6O3 MolecularWeight: 518.99468

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC(=C(C=C3)N4C=CN=C4)Cl)OCCCN5CCOCC5

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC(=C(C=C3)N4C=CN=C4)Cl)OCCCN5CCOCC5

InChI

InChI=1S/C27H27ClN6O3/c1-35-25-14-21-23(15-26(25)37-10-2-6-33-8-11-36-12-9-33)31-17-19(16-29)27(21)32-20-3-4-24(22(28)13-20)34-7-5-30-18-34/h3-5,7,13-15,17-18H,2,6,8-12H2,1H3,(H,31,32)