4-[(3,4-dichlorophenyl)methylsulfanyl]-6,7-dimethoxy-cinnoline

Systemtic Name: 4-[(3,4-dichlorophenyl)methylsulfanyl]-6,7-dimethoxy-cinnoline Openeye Name: 4-[(3,4-dichlorophenyl)methylsulfanyl]-6,7-dimethoxy-cinnoline CAS Name: 4-[(3,4-dichlorophenyl)methylthio]-6,7-dimethoxycinnoline IUPAC Name: 4-[(3,4-dichlorophenyl)methylsulfanyl]-6,7-dimethoxycinnoline Traditional Name: 4-[(3,4-dichlorobenzyl)thio]-6,7-dimethoxy-cinnoline Formula: C17H14Cl2N2O2S MolecularWeight: 381.27626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=CN=N2)SCC3=CC(=C(C=C3)Cl)Cl)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=CN=N2)SCC3=CC(=C(C=C3)Cl)Cl)OC

InChI

InChI=1S/C17H14Cl2N2O2S/c1-22-15-6-11-14(7-16(15)23-2)21-20-8-17(11)24-9-10-3-4-12(18)13(19)5-10/h3-8H,9H2,1-2H3