4-[[4-(1H-imidazol-2-ylmethyl)phenyl]amino]-6-methoxy-7-(3-morpholin-4-ylpropoxy)quinoline-3-carbonitrile

Systemtic Name: 4-[[4-(1H-imidazol-2-ylmethyl)phenyl]amino]-6-methoxy-7-(3-morpholin-4-ylpropoxy)quinoline-3-carbonitrile Openeye Name: 4-[4-(1H-imidazol-2-ylmethyl)anilino]-6-methoxy-7-(3-morpholinopropoxy)quinoline-3-carbonitrile CAS Name: 4-[4-(1H-imidazol-2-ylmethyl)anilino]-6-methoxy-7-[3-(4-morpholinyl)propoxy]-3-quinolinecarbonitrile IUPAC Name: 4-[4-(1H-imidazol-2-ylmethyl)anilino]-6-methoxy-7-(3-morpholin-4-ylpropoxy)quinoline-3-carbonitrile Traditional Name: 4-[4-(1H-imidazol-2-ylmethyl)anilino]-6-methoxy-7-(3-morpholinopropoxy)quinoline-3-carbonitrile Formula: C28H30N6O3 MolecularWeight: 498.5762

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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)CC4=NC=CN4)OCCCN5CCOCC5

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC=C(C=C3)CC4=NC=CN4)OCCCN5CCOCC5

InChI

InChI=1S/C28H30N6O3/c1-35-25-16-23-24(17-26(25)37-12-2-9-34-10-13-36-14-11-34)32-19-21(18-29)28(23)33-22-5-3-20(4-6-22)15-27-30-7-8-31-27/h3-8,16-17,19H,2,9-15H2,1H3,(H,30,31)(H,32,33)