[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl] 2,5-dimethylthiophene-3-carboxylate

Systemtic Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl] 2,5-dimethylthiophene-3-carboxylate Openeye Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxo-ethyl] 2,5-dimethylthiophene-3-carboxylate CAS Name: 2,5-dimethyl-3-thiophenecarboxylic acid [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl] 2,5-dimethylthiophene-3-carboxylate Traditional Name: 2,5-dimethylthiophene-3-carboxylic acid [2-keto-2-(piazthiol-4-ylamino)ethyl] ester Formula: C15H13N3O3S2 MolecularWeight: 347.41202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)OCC(=O)NC2=CC=CC3=NSN=C32

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)OCC(=O)NC2=CC=CC3=NSN=C32

InChI

InChI=1S/C15H13N3O3S2/c1-8-6-10(9(2)22-8)15(20)21-7-13(19)16-11-4-3-5-12-14(11)18-23-17-12/h3-6H,7H2,1-2H3,(H,16,19)