methyl 2-[3-cyano-4-(4-methylphenyl)pyrido[3,2-c]cinnolin-2-yl]sulfanylpropanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=NC3=C2N=NC4=CC=CC=C43)SC(C)C(=O)OC)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=NC3=C2N=NC4=CC=CC=C43)SC(C)C(=O)OC)C#N

InChI

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