4-[3,6-bis(azanyl)-5-cyano-4-(4-ethylphenyl)thieno[2,3-b]pyridin-2-yl]carbonyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide

Systemtic Name: 4-[3,6-bis(azanyl)-5-cyano-4-(4-ethylphenyl)thieno[2,3-b]pyridin-2-yl]carbonyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide Openeye Name: 4-[3,6-diamino-5-cyano-4-(4-ethylphenyl)thieno[2,3-b]pyridine-2-carbonyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide CAS Name: 4-[[3,6-diamino-5-cyano-4-(4-ethylphenyl)-2-thieno[2,3-b]pyridinyl]-oxomethyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide IUPAC Name: 4-[3,6-diamino-5-cyano-4-(4-ethylphenyl)thieno[2,3-b]pyridine-2-carbonyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide Traditional Name: 4-[3,6-diamino-5-cyano-4-(4-ethylphenyl)thieno[2,3-b]pyridine-2-carbonyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide Formula: C26H21N7O3S3 MolecularWeight: 575.68504

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C(C(=NC3=C2C(=C(S3)C(=O)C4=CC=C(C=C4)S(=O)(=O)NC5=NN=C(S5)C)N)N)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C(C(=NC3=C2C(=C(S3)C(=O)C4=CC=C(C=C4)S(=O)(=O)NC5=NN=C(S5)C)N)N)C#N

InChI

InChI=1S/C26H21N7O3S3/c1-3-14-4-6-15(7-5-14)19-18(12-27)24(29)30-25-20(19)21(28)23(38-25)22(34)16-8-10-17(11-9-16)39(35,36)33-26-32-31-13(2)37-26/h4-11H,3,28H2,1-2H3,(H2,29,30)(H,32,33)