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

Systemtic Name: 3-[(3-butyl-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[(3-butyl-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[[(3-butyl-5,6-dimethyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]methyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[(3-butyl-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[[(3-butyl-4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)thio]methyl]-N,N-dimethyl-benzenesulfonamide Formula: C21H27N3O3S3 MolecularWeight: 465.65238

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(N=C1SCC3=CC(=CC=C3)S(=O)(=O)N(C)C)SC(=C2C)C

Isomeric SMILES

CCCCN1C(=O)C2=C(N=C1SCC3=CC(=CC=C3)S(=O)(=O)N(C)C)SC(=C2C)C

InChI

InChI=1S/C21H27N3O3S3/c1-6-7-11-24-20(25)18-14(2)15(3)29-19(18)22-21(24)28-13-16-9-8-10-17(12-16)30(26,27)23(4)5/h8-10,12H,6-7,11,13H2,1-5H3