4-[[2,4-bis(chloranyl)-5-methoxy-phenyl]amino]-7-(4-ethylpiperazin-1-yl)-5-pyridin-2-yl-quinoline-3-carbonitrile

Systemtic Name: 4-[[2,4-bis(chloranyl)-5-methoxy-phenyl]amino]-7-(4-ethylpiperazin-1-yl)-5-pyridin-2-yl-quinoline-3-carbonitrile Openeye Name: 4-(2,4-dichloro-5-methoxy-anilino)-7-(4-ethylpiperazin-1-yl)-5-(2-pyridyl)quinoline-3-carbonitrile CAS Name: 4-(2,4-dichloro-5-methoxyanilino)-7-(4-ethyl-1-piperazinyl)-5-(2-pyridinyl)-3-quinolinecarbonitrile IUPAC Name: 4-(2,4-dichloro-5-methoxyanilino)-7-(4-ethylpiperazin-1-yl)-5-pyridin-2-ylquinoline-3-carbonitrile Traditional Name: 4-(2,4-dichloro-5-methoxy-anilino)-7-(4-ethylpiperazino)-5-(2-pyridyl)quinoline-3-carbonitrile Formula: C28H26Cl2N6O MolecularWeight: 533.45164

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC3=NC=C(C(=C3C(=C2)C4=CC=CC=N4)NC5=CC(=C(C=C5Cl)Cl)OC)C#N

Isomeric SMILES

CCN1CCN(CC1)C2=CC3=NC=C(C(=C3C(=C2)C4=CC=CC=N4)NC5=CC(=C(C=C5Cl)Cl)OC)C#N

InChI

InChI=1S/C28H26Cl2N6O/c1-3-35-8-10-36(11-9-35)19-12-20(23-6-4-5-7-32-23)27-25(13-19)33-17-18(16-31)28(27)34-24-15-26(37-2)22(30)14-21(24)29/h4-7,12-15,17H,3,8-11H2,1-2H3,(H,33,34)