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

Systemtic Name: 4-[3,6-bis(azanyl)-5-cyano-4-(4-propan-2-ylphenyl)thieno[2,3-b]pyridin-2-yl]carbonyl-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide Openeye Name: 4-[3,6-diamino-5-cyano-4-(4-isopropylphenyl)thieno[2,3-b]pyridine-2-carbonyl]-N-(5-methylisoxazol-3-yl)benzenesulfonamide CAS Name: 4-[[3,6-diamino-5-cyano-4-(4-propan-2-ylphenyl)-2-thieno[2,3-b]pyridinyl]-oxomethyl]-N-(5-methyl-3-isoxazolyl)benzenesulfonamide IUPAC Name: 4-[3,6-diamino-5-cyano-4-(4-propan-2-ylphenyl)thieno[2,3-b]pyridine-2-carbonyl]-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide Traditional Name: 4-(3,6-diamino-5-cyano-4-p-cumenyl-thieno[2,3-b]pyridine-2-carbonyl)-N-(5-methylisoxazol-3-yl)benzenesulfonamide Formula: C28H24N6O4S2 MolecularWeight: 572.65796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)C3=C(C4=C(S3)N=C(C(=C4C5=CC=C(C=C5)C(C)C)C#N)N)N

Isomeric SMILES

CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)C3=C(C4=C(S3)N=C(C(=C4C5=CC=C(C=C5)C(C)C)C#N)N)N

InChI

InChI=1S/C28H24N6O4S2/c1-14(2)16-4-6-17(7-5-16)22-20(13-29)27(31)32-28-23(22)24(30)26(39-28)25(35)18-8-10-19(11-9-18)40(36,37)34-21-12-15(3)38-33-21/h4-12,14H,30H2,1-3H3,(H2,31,32)(H,33,34)