4-[2-(4-oxidanylidene-2-sulfanylidene-1H-[1]benzothiolo[3,2-d]pyrimidin-3-yl)ethyl]benzenesulfonamide

Systemtic Name: 4-[2-(4-oxidanylidene-2-sulfanylidene-1H-[1]benzothiolo[3,2-d]pyrimidin-3-yl)ethyl]benzenesulfonamide Openeye Name: 4-[2-(4-oxo-2-thioxo-1H-benzothiopheno[3,2-d]pyrimidin-3-yl)ethyl]benzenesulfonamide CAS Name: 4-[2-(4-oxo-2-sulfanylidene-1H-[1]benzothiolo[3,2-d]pyrimidin-3-yl)ethyl]benzenesulfonamide IUPAC Name: 4-[2-(4-oxo-2-sulfanylidene-1H-[1]benzothiolo[3,2-d]pyrimidin-3-yl)ethyl]benzenesulfonamide Traditional Name: 4-[2-(4-keto-2-thioxo-1H-benzothiopheno[3,2-d]pyrimidin-3-yl)ethyl]benzenesulfonamide Formula: C18H15N3O3S3 MolecularWeight: 417.525

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(S2)C(=O)N(C(=S)N3)CCC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(S2)C(=O)N(C(=S)N3)CCC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C18H15N3O3S3/c19-27(23,24)12-7-5-11(6-8-12)9-10-21-17(22)16-15(20-18(21)25)13-3-1-2-4-14(13)26-16/h1-8H,9-10H2,(H,20,25)(H2,19,23,24)