N-[2-[2-(1,3-dioxan-2-yl)ethylsulfanyl]-1,3-benzothiazol-6-yl]-4-oxidanylidene-6,7-dihydro-5H-1-benzofuran-3-carboxamide

Systemtic Name: N-[2-[2-(1,3-dioxan-2-yl)ethylsulfanyl]-1,3-benzothiazol-6-yl]-4-oxidanylidene-6,7-dihydro-5H-1-benzofuran-3-carboxamide Openeye Name: N-[2-[2-(1,3-dioxan-2-yl)ethylsulfanyl]-1,3-benzothiazol-6-yl]-4-oxo-6,7-dihydro-5H-benzofuran-3-carboxamide CAS Name: N-[2-[2-(1,3-dioxan-2-yl)ethylthio]-1,3-benzothiazol-6-yl]-4-oxo-6,7-dihydro-5H-benzofuran-3-carboxamide IUPAC Name: N-[2-[2-(1,3-dioxan-2-yl)ethylsulfanyl]-1,3-benzothiazol-6-yl]-4-oxo-6,7-dihydro-5H-1-benzofuran-3-carboxamide Traditional Name: N-[2-[2-(1,3-dioxan-2-yl)ethylthio]-1,3-benzothiazol-6-yl]-4-keto-6,7-dihydro-5H-benzofuran-3-carboxamide Formula: C22H22N2O5S2 MolecularWeight: 458.55048

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=O)C1)C(=CO2)C(=O)NC3=CC4=C(C=C3)N=C(S4)SCCC5OCCCO5

Isomeric SMILES

C1CC2=C(C(=O)C1)C(=CO2)C(=O)NC3=CC4=C(C=C3)N=C(S4)SCCC5OCCCO5

InChI

InChI=1S/C22H22N2O5S2/c25-16-3-1-4-17-20(16)14(12-29-17)21(26)23-13-5-6-15-18(11-13)31-22(24-15)30-10-7-19-27-8-2-9-28-19/h5-6,11-12,19H,1-4,7-10H2,(H,23,26)