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

Systemtic Name: methyl 2-(butanoylamino)-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-(butanoylamino)-1,3-benzothiazole-6-carboxylate CAS Name: 2-(1-oxobutylamino)-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(butanoylamino)-1,3-benzothiazole-6-carboxylate Traditional Name: 2-butyramido-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O3S/c1-3-4-11(16)15-13-14-9-6-5-8(12(17)18-2)7-10(9)19-13/h5-7H,3-4H2,1-2H3,(H,14,15,16)