3-cyano-4-(2,5-dimethoxyphenyl)-5,6,7,8-tetrahydroquinoline-2-thiolate

Systemtic Name: 3-cyano-4-(2,5-dimethoxyphenyl)-5,6,7,8-tetrahydroquinoline-2-thiolate Openeye Name: 3-cyano-4-(2,5-dimethoxyphenyl)-5,6,7,8-tetrahydroquinoline-2-thiolate CAS Name: 3-cyano-4-(2,5-dimethoxyphenyl)-5,6,7,8-tetrahydroquinoline-2-thiolate IUPAC Name: 3-cyano-4-(2,5-dimethoxyphenyl)-5,6,7,8-tetrahydroquinoline-2-thiolate Traditional Name: 3-cyano-4-(2,5-dimethoxyphenyl)-5,6,7,8-tetrahydroquinoline-2-thiolate Formula: C18H17N2O2S- MolecularWeight: 325.40478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=C(C(=NC3=C2CCCC3)[S-])C#N

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=C(C(=NC3=C2CCCC3)[S-])C#N

InChI

InChI=1S/C18H18N2O2S/c1-21-11-7-8-16(22-2)13(9-11)17-12-5-3-4-6-15(12)20-18(23)14(17)10-19/h7-9H,3-6H2,1-2H3,(H,20,23)/p-1