methyl 3-(2-ethoxy-2-oxidanylidene-ethyl)-2-propanoylimino-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 3-(2-ethoxy-2-oxidanylidene-ethyl)-2-propanoylimino-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 3-(2-ethoxy-2-oxo-ethyl)-2-propanoylimino-1,3-benzothiazole-6-carboxylate CAS Name: 3-(2-ethoxy-2-oxoethyl)-2-(1-oxopropylimino)-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 3-(2-ethoxy-2-oxoethyl)-2-propanoylimino-1,3-benzothiazole-6-carboxylate Traditional Name: 3-(2-ethoxy-2-keto-ethyl)-2-propionylimino-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C16H18N2O5S MolecularWeight: 350.38952

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N=C1N(C2=C(S1)C=C(C=C2)C(=O)OC)CC(=O)OCC

Isomeric SMILES

CCC(=O)N=C1N(C2=C(S1)C=C(C=C2)C(=O)OC)CC(=O)OCC

InChI

InChI=1S/C16H18N2O5S/c1-4-13(19)17-16-18(9-14(20)23-5-2)11-7-6-10(15(21)22-3)8-12(11)24-16/h6-8H,4-5,9H2,1-3H3