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

Systemtic Name: [2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl] 3-[(2-chlorophenyl)carbonylamino]propanoate Openeye Name: [2-(1,3-benzothiazol-2-ylamino)-2-oxo-ethyl] 3-[(2-chlorobenzoyl)amino]propanoate CAS Name: 3-[[(2-chlorophenyl)-oxomethyl]amino]propanoic acid [2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl] 3-[(2-chlorobenzoyl)amino]propanoate Traditional Name: 3-[(2-chlorobenzoyl)amino]propionic acid [2-(1,3-benzothiazol-2-ylamino)-2-keto-ethyl] ester Formula: C19H16ClN3O4S MolecularWeight: 417.86604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCCC(=O)OCC(=O)NC2=NC3=CC=CC=C3S2)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCCC(=O)OCC(=O)NC2=NC3=CC=CC=C3S2)Cl

InChI

InChI=1S/C19H16ClN3O4S/c20-13-6-2-1-5-12(13)18(26)21-10-9-17(25)27-11-16(24)23-19-22-14-7-3-4-8-15(14)28-19/h1-8H,9-11H2,(H,21,26)(H,22,23,24)