methyl 3-(2-methoxy-2-oxidanylidene-ethyl)-2-(2-methylpropanoylimino)-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 3-(2-methoxy-2-oxidanylidene-ethyl)-2-(2-methylpropanoylimino)-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 3-(2-methoxy-2-oxo-ethyl)-2-(2-methylpropanoylimino)-1,3-benzothiazole-6-carboxylate CAS Name: 3-(2-methoxy-2-oxoethyl)-2-(2-methyl-1-oxopropyl)imino-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 3-(2-methoxy-2-oxoethyl)-2-(2-methylpropanoylimino)-1,3-benzothiazole-6-carboxylate Traditional Name: 2-isobutyrylimino-3-(2-keto-2-methoxy-ethyl)-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C16H18N2O5S MolecularWeight: 350.38952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O5S/c1-9(2)14(20)17-16-18(8-13(19)22-3)11-6-5-10(15(21)23-4)7-12(11)24-16/h5-7,9H,8H2,1-4H3