methyl 2-(2-methylpropanoylamino)-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-(2-methylpropanoylamino)-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-(2-methylpropanoylamino)-1,3-benzothiazole-6-carboxylate CAS Name: 2-[(2-methyl-1-oxopropyl)amino]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(2-methylpropanoylamino)-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(isobutyrylamino)-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C)C(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)OC

InChI

InChI=1S/C13H14N2O3S/c1-7(2)11(16)15-13-14-9-5-4-8(12(17)18-3)6-10(9)19-13/h4-7H,1-3H3,(H,14,15,16)