N-[4-[5-(5-cyano-6-oxidanyl-4-oxidanylidene-7H-thieno[2,3-b]pyridin-3-yl)-3-methyl-thiophen-2-yl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[5-(5-cyano-6-oxidanyl-4-oxidanylidene-7H-thieno[2,3-b]pyridin-3-yl)-3-methyl-thiophen-2-yl]phenyl]methanesulfonamide Openeye Name: N-[4-[5-(5-cyano-6-hydroxy-4-oxo-7H-thieno[2,3-b]pyridin-3-yl)-3-methyl-2-thienyl]phenyl]methanesulfonamide CAS Name: N-[4-[5-(5-cyano-6-hydroxy-4-oxo-7H-thieno[2,3-b]pyridin-3-yl)-3-methyl-2-thiophenyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[5-(5-cyano-6-hydroxy-4-oxo-7H-thieno[2,3-b]pyridin-3-yl)-3-methylthiophen-2-yl]phenyl]methanesulfonamide Traditional Name: N-[4-[5-(5-cyano-6-hydroxy-4-keto-7H-thieno[2,3-b]pyridin-3-yl)-3-methyl-2-thienyl]phenyl]methanesulfonamide Formula: C20H15N3O4S3 MolecularWeight: 457.5458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)C2=CSC3=C2C(=O)C(=C(N3)O)C#N)C4=CC=C(C=C4)NS(=O)(=O)C

Isomeric SMILES

CC1=C(SC(=C1)C2=CSC3=C2C(=O)C(=C(N3)O)C#N)C4=CC=C(C=C4)NS(=O)(=O)C

InChI

InChI=1S/C20H15N3O4S3/c1-10-7-15(14-9-28-20-16(14)17(24)13(8-21)19(25)22-20)29-18(10)11-3-5-12(6-4-11)23-30(2,26)27/h3-7,9,23H,1-2H3,(H2,22,24,25)