4-[2-(3-butyl-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanylethoxy]benzenesulfonamide

Systemtic Name: 4-[2-(3-butyl-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanylethoxy]benzenesulfonamide Openeye Name: 4-[2-(3-butyl-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanylethoxy]benzenesulfonamide CAS Name: 4-[2-[(3-butyl-5,6-dimethyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]ethoxy]benzenesulfonamide IUPAC Name: 4-[2-(3-butyl-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanylethoxy]benzenesulfonamide Traditional Name: 4-[2-[(3-butyl-4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)thio]ethoxy]benzenesulfonamide Formula: C20H25N3O4S3 MolecularWeight: 467.6252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(N=C1SCCOC3=CC=C(C=C3)S(=O)(=O)N)SC(=C2C)C

Isomeric SMILES

CCCCN1C(=O)C2=C(N=C1SCCOC3=CC=C(C=C3)S(=O)(=O)N)SC(=C2C)C

InChI

InChI=1S/C20H25N3O4S3/c1-4-5-10-23-19(24)17-13(2)14(3)29-18(17)22-20(23)28-12-11-27-15-6-8-16(9-7-15)30(21,25)26/h6-9H,4-5,10-12H2,1-3H3,(H2,21,25,26)