ethyl 2-[3-cyano-4-(4-methylphenyl)pyrido[3,2-c]cinnolin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[3-cyano-4-(4-methylphenyl)pyrido[3,2-c]cinnolin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[3-cyano-4-(p-tolyl)pyrido[3,2-c]cinnolin-2-yl]sulfanylacetate CAS Name: 2-[[3-cyano-4-(4-methylphenyl)-2-pyrido[3,2-c]cinnolinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-cyano-4-(4-methylphenyl)pyrido[3,2-c]cinnolin-2-yl]sulfanylacetate Traditional Name: 2-[[3-cyano-4-(p-tolyl)pyrido[3,2-c]cinnolin-2-yl]thio]acetic acid ethyl ester Formula: C23H18N4O2S MolecularWeight: 414.47962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=C(C(=C1C#N)C3=CC=C(C=C3)C)N=NC4=CC=CC=C42

Isomeric SMILES

CCOC(=O)CSC1=NC2=C(C(=C1C#N)C3=CC=C(C=C3)C)N=NC4=CC=CC=C42

InChI

InChI=1S/C23H18N4O2S/c1-3-29-19(28)13-30-23-17(12-24)20(15-10-8-14(2)9-11-15)22-21(25-23)16-6-4-5-7-18(16)26-27-22/h4-11H,3,13H2,1-2H3