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

Systemtic Name: [2-oxidanylidene-2-(phenethylamino)ethyl] 1,3-benzothiazole-6-carboxylate Openeye Name: [2-oxo-2-(phenethylamino)ethyl] 1,3-benzothiazole-6-carboxylate CAS Name: 1,3-benzothiazole-6-carboxylic acid [2-oxo-2-(phenethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(phenethylamino)ethyl] 1,3-benzothiazole-6-carboxylate Traditional Name: 1,3-benzothiazole-6-carboxylic acid [2-keto-2-(phenethylamino)ethyl] ester Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)COC(=O)C2=CC3=C(C=C2)N=CS3

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)COC(=O)C2=CC3=C(C=C2)N=CS3

InChI

InChI=1S/C18H16N2O3S/c21-17(19-9-8-13-4-2-1-3-5-13)11-23-18(22)14-6-7-15-16(10-14)24-12-20-15/h1-7,10,12H,8-9,11H2,(H,19,21)