4-[[2,4-bis(chloranyl)-5-methoxy-phenyl]amino]-7-ethylsulfanyl-6-methoxy-quinoline-3-carbonitrile

Systemtic Name: 4-[[2,4-bis(chloranyl)-5-methoxy-phenyl]amino]-7-ethylsulfanyl-6-methoxy-quinoline-3-carbonitrile Openeye Name: 4-(2,4-dichloro-5-methoxy-anilino)-7-ethylsulfanyl-6-methoxy-quinoline-3-carbonitrile CAS Name: 4-(2,4-dichloro-5-methoxyanilino)-7-(ethylthio)-6-methoxy-3-quinolinecarbonitrile IUPAC Name: 4-(2,4-dichloro-5-methoxyanilino)-7-ethylsulfanyl-6-methoxyquinoline-3-carbonitrile Traditional Name: 4-(2,4-dichloro-5-methoxy-anilino)-7-(ethylthio)-6-methoxy-quinoline-3-carbonitrile Formula: C20H17Cl2N3O2S MolecularWeight: 434.33888

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3Cl)Cl)OC)C#N)OC

Isomeric SMILES

CCSC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3Cl)Cl)OC)C#N)OC

InChI

InChI=1S/C20H17Cl2N3O2S/c1-4-28-19-8-15-12(5-18(19)27-3)20(11(9-23)10-24-15)25-16-7-17(26-2)14(22)6-13(16)21/h5-8,10H,4H2,1-3H3,(H,24,25)