[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl] 4-phenoxybutanoate

Systemtic Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl] 4-phenoxybutanoate Openeye Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxo-ethyl] 4-phenoxybutanoate CAS Name: 4-phenoxybutanoic acid [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl] 4-phenoxybutanoate Traditional Name: 4-phenoxybutyric acid [2-keto-2-(piazthiol-4-ylamino)ethyl] ester Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCC(=O)OCC(=O)NC2=CC=CC3=NSN=C32

Isomeric SMILES

C1=CC=C(C=C1)OCCCC(=O)OCC(=O)NC2=CC=CC3=NSN=C32

InChI

InChI=1S/C18H17N3O4S/c22-16(19-14-8-4-9-15-18(14)21-26-20-15)12-25-17(23)10-5-11-24-13-6-2-1-3-7-13/h1-4,6-9H,5,10-12H2,(H,19,22)