2-[5-(4-methylphenyl)-4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(4-sulfamoylphenyl)ethanamide

Systemtic Name: 2-[5-(4-methylphenyl)-4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(4-sulfamoylphenyl)ethanamide Openeye Name: 2-[4-oxo-3-phenyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(4-sulfamoylphenyl)acetamide CAS Name: 2-[[5-(4-methylphenyl)-4-oxo-3-phenyl-2-thieno[2,3-d]pyrimidinyl]thio]-N-(4-sulfamoylphenyl)acetamide IUPAC Name: 2-[5-(4-methylphenyl)-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(4-sulfamoylphenyl)acetamide Traditional Name: 2-[[4-keto-3-phenyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-2-yl]thio]-N-(4-sulfamoylphenyl)acetamide Formula: C27H22N4O4S3 MolecularWeight: 562.68298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)NC4=CC=C(C=C4)S(=O)(=O)N)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)NC4=CC=C(C=C4)S(=O)(=O)N)C5=CC=CC=C5

InChI

InChI=1S/C27H22N4O4S3/c1-17-7-9-18(10-8-17)22-15-36-25-24(22)26(33)31(20-5-3-2-4-6-20)27(30-25)37-16-23(32)29-19-11-13-21(14-12-19)38(28,34)35/h2-15H,16H2,1H3,(H,29,32)(H2,28,34,35)