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

Systemtic Name: 4-[2-(3-cyclopentyl-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanylethoxy]benzenesulfonamide Openeye Name: 4-[2-(3-cyclopentyl-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanylethoxy]benzenesulfonamide CAS Name: 4-[2-[(3-cyclopentyl-5,6-dimethyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]ethoxy]benzenesulfonamide IUPAC Name: 4-[2-(3-cyclopentyl-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanylethoxy]benzenesulfonamide Traditional Name: 4-[2-[(3-cyclopentyl-4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)thio]ethoxy]benzenesulfonamide Formula: C21H25N3O4S3 MolecularWeight: 479.6359

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCCOC3=CC=C(C=C3)S(=O)(=O)N)C4CCCC4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCCOC3=CC=C(C=C3)S(=O)(=O)N)C4CCCC4)C

InChI

InChI=1S/C21H25N3O4S3/c1-13-14(2)30-19-18(13)20(25)24(15-5-3-4-6-15)21(23-19)29-12-11-28-16-7-9-17(10-8-16)31(22,26)27/h7-10,15H,3-6,11-12H2,1-2H3,(H2,22,26,27)