2-(3-cyano-2-oxidanylidene-1H-pyridin-4-yl)-N,N-bis(2-hydroxyethyl)benzenesulfonamide

Systemtic Name: 2-(3-cyano-2-oxidanylidene-1H-pyridin-4-yl)-N,N-bis(2-hydroxyethyl)benzenesulfonamide Openeye Name: 2-(3-cyano-2-oxo-1H-pyridin-4-yl)-N,N-bis(2-hydroxyethyl)benzenesulfonamide CAS Name: 2-(3-cyano-2-oxo-1H-pyridin-4-yl)-N,N-bis(2-hydroxyethyl)benzenesulfonamide IUPAC Name: 2-(3-cyano-2-oxo-1H-pyridin-4-yl)-N,N-bis(2-hydroxyethyl)benzenesulfonamide Traditional Name: 2-(3-cyano-2-keto-1H-pyridin-4-yl)-N,N-bis(2-hydroxyethyl)benzenesulfonamide Formula: C16H17N3O5S MolecularWeight: 363.38828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C(C(=O)NC=C2)C#N)S(=O)(=O)N(CCO)CCO

Isomeric SMILES

C1=CC=C(C(=C1)C2=C(C(=O)NC=C2)C#N)S(=O)(=O)N(CCO)CCO

InChI

InChI=1S/C16H17N3O5S/c17-11-14-12(5-6-18-16(14)22)13-3-1-2-4-15(13)25(23,24)19(7-9-20)8-10-21/h1-6,20-21H,7-10H2,(H,18,22)