4-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl]-N-[2-(4-sulfamoylphenyl)ethyl]butanamide

Systemtic Name: 4-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl]-N-[2-(4-sulfamoylphenyl)ethyl]butanamide Openeye Name: 4-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-thieno[3,2-d]pyrimidin-3-yl]-N-[2-(4-sulfamoylphenyl)ethyl]butanamide CAS Name: 4-[2-[(4-fluorophenyl)methylthio]-4-oxo-3-thieno[3,2-d]pyrimidinyl]-N-[2-(4-sulfamoylphenyl)ethyl]butanamide IUPAC Name: 4-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxothieno[3,2-d]pyrimidin-3-yl]-N-[2-(4-sulfamoylphenyl)ethyl]butanamide Traditional Name: 4-[2-[(4-fluorobenzyl)thio]-4-keto-thieno[3,2-d]pyrimidin-3-yl]-N-[2-(4-sulfamoylphenyl)ethyl]butyramide Formula: C25H25FN4O4S3 MolecularWeight: 560.683803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC(=O)CCCN2C(=O)C3=C(C=CS3)N=C2SCC4=CC=C(C=C4)F)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1CCNC(=O)CCCN2C(=O)C3=C(C=CS3)N=C2SCC4=CC=C(C=C4)F)S(=O)(=O)N

InChI

InChI=1S/C25H25FN4O4S3/c26-19-7-3-18(4-8-19)16-36-25-29-21-12-15-35-23(21)24(32)30(25)14-1-2-22(31)28-13-11-17-5-9-20(10-6-17)37(27,33)34/h3-10,12,15H,1-2,11,13-14,16H2,(H,28,31)(H2,27,33,34)