4-chloranyl-2-sulfanyl-N-([1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide

Systemtic Name: 4-chloranyl-2-sulfanyl-N-([1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide Openeye Name: 4-chloro-2-sulfanyl-N-([1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide CAS Name: 4-chloro-2-mercapto-N-([1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide IUPAC Name: 4-chloro-2-sulfanyl-N-([1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide Traditional Name: 4-chloro-2-mercapto-N-([1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide Formula: C15H10ClN5O2S2 MolecularWeight: 391.8552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NN3C2=NN=C3NS(=O)(=O)C4=C(C=C(C=C4)Cl)S

Isomeric SMILES

C1=CC=C2C(=C1)C=NN3C2=NN=C3NS(=O)(=O)C4=C(C=C(C=C4)Cl)S

InChI

InChI=1S/C15H10ClN5O2S2/c16-10-5-6-13(12(24)7-10)25(22,23)20-15-19-18-14-11-4-2-1-3-9(11)8-17-21(14)15/h1-8,24H,(H,19,20)