ethyl 2-(1,3-benzodioxol-5-ylcarbonylimino)-3-methyl-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-(1,3-benzodioxol-5-ylcarbonylimino)-3-methyl-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-(1,3-benzodioxole-5-carbonylimino)-3-methyl-1,3-benzothiazole-6-carboxylate CAS Name: 2-[1,3-benzodioxol-5-yl(oxo)methyl]imino-3-methyl-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(1,3-benzodioxole-5-carbonylimino)-3-methyl-1,3-benzothiazole-6-carboxylate Traditional Name: 3-methyl-2-piperonyloylimino-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C19H16N2O5S MolecularWeight: 384.40574

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)C3=CC4=C(C=C3)OCO4)S2)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)C3=CC4=C(C=C3)OCO4)S2)C

InChI

InChI=1S/C19H16N2O5S/c1-3-24-18(23)12-4-6-13-16(9-12)27-19(21(13)2)20-17(22)11-5-7-14-15(8-11)26-10-25-14/h4-9H,3,10H2,1-2H3