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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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