N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide

Systemtic Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide Openeye Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide CAS Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-2,3-dihydro-1,4-dioxin-5-carboxamide IUPAC Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide Traditional Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-2,3-dihydro-p-dioxin-5-carboxamide Formula: C13H12N2O3S2 MolecularWeight: 308.37598

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=COCCO3

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=COCCO3

InChI

InChI=1S/C13H12N2O3S2/c1-19-13-15-9-3-2-8(6-11(9)20-13)14-12(16)10-7-17-4-5-18-10/h2-3,6-7H,4-5H2,1H3,(H,14,16)