ethyl 3-[2-(2,3-dihydro-1,4-dioxin-5-ylcarbonylimino)-6-methyl-1,3-benzothiazol-3-yl]propanoate

Systemtic Name: ethyl 3-[2-(2,3-dihydro-1,4-dioxin-5-ylcarbonylimino)-6-methyl-1,3-benzothiazol-3-yl]propanoate Openeye Name: ethyl 3-[2-(2,3-dihydro-1,4-dioxine-5-carbonylimino)-6-methyl-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[2-[2,3-dihydro-1,4-dioxin-5-yl(oxo)methyl]imino-6-methyl-1,3-benzothiazol-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[2-(2,3-dihydro-1,4-dioxine-5-carbonylimino)-6-methyl-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-[2-(2,3-dihydro-p-dioxin-5-carbonylimino)-6-methyl-1,3-benzothiazol-3-yl]propionic acid ethyl ester Formula: C18H20N2O5S MolecularWeight: 376.4268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C2=C(C=C(C=C2)C)SC1=NC(=O)C3=COCCO3

Isomeric SMILES

CCOC(=O)CCN1C2=C(C=C(C=C2)C)SC1=NC(=O)C3=COCCO3

InChI

InChI=1S/C18H20N2O5S/c1-3-24-16(21)6-7-20-13-5-4-12(2)10-15(13)26-18(20)19-17(22)14-11-23-8-9-25-14/h4-5,10-11H,3,6-9H2,1-2H3