3-(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide

Systemtic Name: 3-(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide Openeye Name: 3-(4-oxo-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide CAS Name: 3-(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide IUPAC Name: 3-(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide Traditional Name: 3-(4-keto-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propionamide Formula: C17H18N4O4S3 MolecularWeight: 438.54422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC(=O)CCN2C(=O)C3=C(C=CS3)NC2=S)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1CCNC(=O)CCN2C(=O)C3=C(C=CS3)NC2=S)S(=O)(=O)N

InChI

InChI=1S/C17H18N4O4S3/c18-28(24,25)12-3-1-11(2-4-12)5-8-19-14(22)6-9-21-16(23)15-13(7-10-27-15)20-17(21)26/h1-4,7,10H,5-6,8-9H2,(H,19,22)(H,20,26)(H2,18,24,25)