2-[3-cyano-4-(4-methylphenyl)pyrido[3,2-c]cinnolin-2-yl]sulfanyl-N-(4-methoxyphenyl)ethanamide

Systemtic Name: 2-[3-cyano-4-(4-methylphenyl)pyrido[3,2-c]cinnolin-2-yl]sulfanyl-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-[3-cyano-4-(p-tolyl)pyrido[3,2-c]cinnolin-2-yl]sulfanyl-N-(4-methoxyphenyl)acetamide CAS Name: 2-[[3-cyano-4-(4-methylphenyl)-2-pyrido[3,2-c]cinnolinyl]thio]-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-[3-cyano-4-(4-methylphenyl)pyrido[3,2-c]cinnolin-2-yl]sulfanyl-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[[3-cyano-4-(p-tolyl)pyrido[3,2-c]cinnolin-2-yl]thio]-N-(4-methoxyphenyl)acetamide Formula: C28H21N5O2S MolecularWeight: 491.56364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=NC3=C2N=NC4=CC=CC=C43)SCC(=O)NC5=CC=C(C=C5)OC)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=NC3=C2N=NC4=CC=CC=C43)SCC(=O)NC5=CC=C(C=C5)OC)C#N

InChI

InChI=1S/C28H21N5O2S/c1-17-7-9-18(10-8-17)25-22(15-29)28(31-26-21-5-3-4-6-23(21)32-33-27(25)26)36-16-24(34)30-19-11-13-20(35-2)14-12-19/h3-14H,16H2,1-2H3,(H,30,34)