N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2-oxidanylidene-chromene-6-sulfonamide

Systemtic Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2-oxidanylidene-chromene-6-sulfonamide Openeye Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2-oxo-chromene-6-sulfonamide CAS Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-2-oxo-1-benzopyran-6-sulfonamide IUPAC Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2-oxochromene-6-sulfonamide Traditional Name: 2-keto-N-[2-(methylthio)-1,3-benzothiazol-6-yl]chromene-6-sulfonamide Formula: C17H12N2O4S3 MolecularWeight: 404.48318

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OC(=O)C=C4

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OC(=O)C=C4

InChI

InChI=1S/C17H12N2O4S3/c1-24-17-18-13-5-3-11(9-15(13)25-17)19-26(21,22)12-4-6-14-10(8-12)2-7-16(20)23-14/h2-9,19H,1H3