[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl] 2-(2-cyanophenoxy)ethanoate

Systemtic Name: [2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl] 2-(2-cyanophenoxy)ethanoate Openeye Name: [2-(1,3-benzothiazol-2-ylamino)-2-oxo-ethyl] 2-(2-cyanophenoxy)acetate CAS Name: 2-(2-cyanophenoxy)acetic acid [2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl] 2-(2-cyanophenoxy)acetate Traditional Name: 2-(2-cyanophenoxy)acetic acid [2-(1,3-benzothiazol-2-ylamino)-2-keto-ethyl] ester Formula: C18H13N3O4S MolecularWeight: 367.37852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)OCC(=O)OCC(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1=CC=C(C(=C1)C#N)OCC(=O)OCC(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H13N3O4S/c19-9-12-5-1-3-7-14(12)24-11-17(23)25-10-16(22)21-18-20-13-6-2-4-8-15(13)26-18/h1-8H,10-11H2,(H,20,21,22)