3-(dimethylsulfamoyl)-N-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoyl)benzamide

Systemtic Name: 3-(dimethylsulfamoyl)-N-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoyl)benzamide Openeye Name: 3-(dimethylsulfamoyl)-N-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)benzamide CAS Name: 3-(dimethylsulfamoyl)-N-[1-oxo-2-(4-thieno[2,3-d]pyrimidinylthio)ethyl]benzamide IUPAC Name: 3-(dimethylsulfamoyl)-N-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)benzamide Traditional Name: 3-(dimethylsulfamoyl)-N-[2-(thieno[2,3-d]pyrimidin-4-ylthio)acetyl]benzamide Formula: C17H16N4O4S3 MolecularWeight: 436.52834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)NC(=O)CSC2=NC=NC3=C2C=CS3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)NC(=O)CSC2=NC=NC3=C2C=CS3

InChI

InChI=1S/C17H16N4O4S3/c1-21(2)28(24,25)12-5-3-4-11(8-12)15(23)20-14(22)9-27-17-13-6-7-26-16(13)18-10-19-17/h3-8,10H,9H2,1-2H3,(H,20,22,23)