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

Systemtic Name: N,N-dimethyl-3-[(3-methyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]benzenesulfonamide Openeye Name: N,N-dimethyl-3-[(3-methyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]benzenesulfonamide CAS Name: N,N-dimethyl-3-[[(3-methyl-4-oxo-5-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]methyl]benzenesulfonamide IUPAC Name: N,N-dimethyl-3-[(3-methyl-4-oxo-5-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]benzenesulfonamide Traditional Name: 3-[[(4-keto-3-methyl-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]methyl]-N,N-dimethyl-benzenesulfonamide Formula: C22H21N3O3S3 MolecularWeight: 471.61544

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCC3=CC(=CC=C3)S(=O)(=O)N(C)C)SC=C2C4=CC=CC=C4

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCC3=CC(=CC=C3)S(=O)(=O)N(C)C)SC=C2C4=CC=CC=C4

InChI

InChI=1S/C22H21N3O3S3/c1-24(2)31(27,28)17-11-7-8-15(12-17)13-30-22-23-20-19(21(26)25(22)3)18(14-29-20)16-9-5-4-6-10-16/h4-12,14H,13H2,1-3H3