3-[4,6-bis(azanyl)-5-cyano-2-oxidanylidene-3H-pyrrolo[2,3-b]pyridin-1-yl]benzenesulfonamide

Systemtic Name: 3-[4,6-bis(azanyl)-5-cyano-2-oxidanylidene-3H-pyrrolo[2,3-b]pyridin-1-yl]benzenesulfonamide Openeye Name: 3-(4,6-diamino-5-cyano-2-oxo-3H-pyrrolo[2,3-b]pyridin-1-yl)benzenesulfonamide CAS Name: 3-(4,6-diamino-5-cyano-2-oxo-3H-pyrrolo[2,3-b]pyridin-1-yl)benzenesulfonamide IUPAC Name: 3-(4,6-diamino-5-cyano-2-oxo-3H-pyrrolo[2,3-b]pyridin-1-yl)benzenesulfonamide Traditional Name: 3-(4,6-diamino-5-cyano-2-keto-3H-pyrrolo[2,3-b]pyridin-1-yl)benzenesulfonamide Formula: C14H12N6O3S MolecularWeight: 344.34848

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(N=C(C(=C2N)C#N)N)N(C1=O)C3=CC(=CC=C3)S(=O)(=O)N

Isomeric SMILES

C1C2=C(N=C(C(=C2N)C#N)N)N(C1=O)C3=CC(=CC=C3)S(=O)(=O)N

InChI

InChI=1S/C14H12N6O3S/c15-6-10-12(16)9-5-11(21)20(14(9)19-13(10)17)7-2-1-3-8(4-7)24(18,22)23/h1-4H,5H2,(H4,16,17,19)(H2,18,22,23)