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

Systemtic Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl] 4-thiophen-2-ylbutanoate Openeye Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxo-ethyl] 4-(2-thienyl)butanoate CAS Name: 4-thiophen-2-ylbutanoic acid [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl] 4-thiophen-2-ylbutanoate Traditional Name: 4-(2-thienyl)butyric acid [2-keto-2-(piazthiol-4-ylamino)ethyl] ester Formula: C16H15N3O3S2 MolecularWeight: 361.4386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NSN=C2C(=C1)NC(=O)COC(=O)CCCC3=CC=CS3

Isomeric SMILES

C1=CC2=NSN=C2C(=C1)NC(=O)COC(=O)CCCC3=CC=CS3

InChI

InChI=1S/C16H15N3O3S2/c20-14(17-12-6-2-7-13-16(12)19-24-18-13)10-22-15(21)8-1-4-11-5-3-9-23-11/h2-3,5-7,9H,1,4,8,10H2,(H,17,20)