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

Systemtic Name: ethyl 2-(2-chloranylpropanoylamino)-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-(2-chloropropanoylamino)-1,3-benzothiazole-6-carboxylate CAS Name: 2-[(2-chloro-1-oxopropyl)amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(2-chloropropanoylamino)-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(2-chloropropanoylamino)-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C13H13ClN2O3S MolecularWeight: 312.77192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C(C)Cl

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C(C)Cl

InChI

InChI=1S/C13H13ClN2O3S/c1-3-19-12(18)8-4-5-9-10(6-8)20-13(15-9)16-11(17)7(2)14/h4-7H,3H2,1-2H3,(H,15,16,17)