5-(2-chloranylcyclohexa-1,5-dien-1-yl)-2-(hydroxymethyl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-sulfonamide

Systemtic Name: 5-(2-chloranylcyclohexa-1,5-dien-1-yl)-2-(hydroxymethyl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-sulfonamide Openeye Name: 5-(2-chlorocyclohexa-1,5-dien-1-yl)-2-(hydroxymethyl)-4-oxo-3H-thieno[2,3-d]pyrimidine-6-sulfonamide CAS Name: 5-(2-chloro-1-cyclohexa-1,5-dienyl)-2-(hydroxymethyl)-4-oxo-3H-thieno[2,3-d]pyrimidine-6-sulfonamide IUPAC Name: 5-(2-chlorocyclohexa-1,5-dien-1-yl)-2-(hydroxymethyl)-4-oxo-3H-thieno[2,3-d]pyrimidine-6-sulfonamide Traditional Name: 5-(2-chlorocyclohexa-1,5-dien-1-yl)-4-keto-2-methylol-3H-thieno[2,3-d]pyrimidine-6-sulfonamide Formula: C13H12ClN3O4S2 MolecularWeight: 373.83508

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C=C1)C2=C(SC3=C2C(=O)NC(=N3)CO)S(=O)(=O)N)Cl

Isomeric SMILES

C1CC(=C(C=C1)C2=C(SC3=C2C(=O)NC(=N3)CO)S(=O)(=O)N)Cl

InChI

InChI=1S/C13H12ClN3O4S2/c14-7-4-2-1-3-6(7)9-10-11(19)16-8(5-18)17-12(10)22-13(9)23(15,20)21/h1,3,18H,2,4-5H2,(H2,15,20,21)(H,16,17,19)