2-[(3,4-dichlorophenyl)methylsulfanyl]-7-methoxy-4-pyridin-3-yl-quinoline

Systemtic Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-7-methoxy-4-pyridin-3-yl-quinoline Openeye Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-7-methoxy-4-(3-pyridyl)quinoline CAS Name: 2-[(3,4-dichlorophenyl)methylthio]-7-methoxy-4-(3-pyridinyl)quinoline IUPAC Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-7-methoxy-4-pyridin-3-ylquinoline Traditional Name: 2-[(3,4-dichlorobenzyl)thio]-7-methoxy-4-(3-pyridyl)quinoline Formula: C22H16Cl2N2OS MolecularWeight: 427.34624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=N2)SCC3=CC(=C(C=C3)Cl)Cl)C4=CN=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=N2)SCC3=CC(=C(C=C3)Cl)Cl)C4=CN=CC=C4

InChI

InChI=1S/C22H16Cl2N2OS/c1-27-16-5-6-17-18(15-3-2-8-25-12-15)11-22(26-21(17)10-16)28-13-14-4-7-19(23)20(24)9-14/h2-12H,13H2,1H3