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

Systemtic Name: ethyl 2-(3-phenylpropanoylamino)-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-(3-phenylpropanoylamino)-1,3-benzothiazole-6-carboxylate CAS Name: 2-[(1-oxo-3-phenylpropyl)amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(3-phenylpropanoylamino)-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(hydrocinnamoylamino)-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C19H18N2O3S/c1-2-24-18(23)14-9-10-15-16(12-14)25-19(20-15)21-17(22)11-8-13-6-4-3-5-7-13/h3-7,9-10,12H,2,8,11H2,1H3,(H,20,21,22)