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

Systemtic Name: methyl 2-(2-chloranylpropanoylamino)-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-(2-chloropropanoylamino)-1,3-benzothiazole-6-carboxylate CAS Name: 2-[(2-chloro-1-oxopropyl)amino]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(2-chloropropanoylamino)-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(2-chloropropanoylamino)-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C12H11ClN2O3S MolecularWeight: 298.74534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11ClN2O3S/c1-6(13)10(16)15-12-14-8-4-3-7(11(17)18-2)5-9(8)19-12/h3-6H,1-2H3,(H,14,15,16)