[2-oxidanylidene-2-(prop-2-enylamino)ethyl] 1,3-benzothiazole-6-carboxylate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylamino)ethyl] 1,3-benzothiazole-6-carboxylate Openeye Name: [2-(allylamino)-2-oxo-ethyl] 1,3-benzothiazole-6-carboxylate CAS Name: 1,3-benzothiazole-6-carboxylic acid [2-oxo-2-(prop-2-enylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylamino)ethyl] 1,3-benzothiazole-6-carboxylate Traditional Name: 1,3-benzothiazole-6-carboxylic acid [2-(allylamino)-2-keto-ethyl] ester Formula: C13H12N2O3S MolecularWeight: 276.31098

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)COC(=O)C1=CC2=C(C=C1)N=CS2

Isomeric SMILES

C=CCNC(=O)COC(=O)C1=CC2=C(C=C1)N=CS2

InChI

InChI=1S/C13H12N2O3S/c1-2-5-14-12(16)7-18-13(17)9-3-4-10-11(6-9)19-8-15-10/h2-4,6,8H,1,5,7H2,(H,14,16)