[2-[(2-chlorophenyl)carbonylamino]-2-oxidanylidene-ethyl] 3-(1,3-benzothiazol-2-yl)propanoate

Systemtic Name: [2-[(2-chlorophenyl)carbonylamino]-2-oxidanylidene-ethyl] 3-(1,3-benzothiazol-2-yl)propanoate Openeye Name: [2-[(2-chlorobenzoyl)amino]-2-oxo-ethyl] 3-(1,3-benzothiazol-2-yl)propanoate CAS Name: 3-(1,3-benzothiazol-2-yl)propanoic acid [2-[[(2-chlorophenyl)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[(2-chlorobenzoyl)amino]-2-oxoethyl] 3-(1,3-benzothiazol-2-yl)propanoate Traditional Name: 3-(1,3-benzothiazol-2-yl)propionic acid [2-[(2-chlorobenzoyl)amino]-2-keto-ethyl] ester Formula: C19H15ClN2O4S MolecularWeight: 402.8514

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(=O)COC(=O)CCC2=NC3=CC=CC=C3S2)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC(=O)COC(=O)CCC2=NC3=CC=CC=C3S2)Cl

InChI

InChI=1S/C19H15ClN2O4S/c20-13-6-2-1-5-12(13)19(25)22-16(23)11-26-18(24)10-9-17-21-14-7-3-4-8-15(14)27-17/h1-8H,9-11H2,(H,22,23,25)