4-[(3-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(4-sulfamoylphenyl)butanamide

Systemtic Name: 4-[(3-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(4-sulfamoylphenyl)butanamide Openeye Name: 4-[(3-methyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(4-sulfamoylphenyl)butanamide CAS Name: 4-[(3-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)thio]-N-(4-sulfamoylphenyl)butanamide IUPAC Name: 4-[(3-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(4-sulfamoylphenyl)butanamide Traditional Name: 4-[(4-keto-3-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)thio]-N-(4-sulfamoylphenyl)butyramide Formula: C21H24N4O4S3 MolecularWeight: 492.63466

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCCCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N)SC4=C2CCCC4

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCCCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N)SC4=C2CCCC4

InChI

InChI=1S/C21H24N4O4S3/c1-25-20(27)18-15-5-2-3-6-16(15)31-19(18)24-21(25)30-12-4-7-17(26)23-13-8-10-14(11-9-13)32(22,28)29/h8-11H,2-7,12H2,1H3,(H,23,26)(H2,22,28,29)