diethyl 2-[(1,2,3-benzothiadiazol-5-ylamino)methylidene]propanedioate

Systemtic Name: diethyl 2-[(1,2,3-benzothiadiazol-5-ylamino)methylidene]propanedioate Openeye Name: diethyl 2-[(1,2,3-benzothiadiazol-5-ylamino)methylene]propanedioate CAS Name: 2-[(1,2,3-benzothiadiazol-5-ylamino)methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(1,2,3-benzothiadiazol-5-ylamino)methylidene]propanedioate Traditional Name: 2-[(1,2,3-benzothiadiazol-5-ylamino)methylene]malonic acid diethyl ester Formula: C14H15N3O4S MolecularWeight: 321.3516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC2=C(C=C1)SN=N2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC1=CC2=C(C=C1)SN=N2)C(=O)OCC

InChI

InChI=1S/C14H15N3O4S/c1-3-20-13(18)10(14(19)21-4-2)8-15-9-5-6-12-11(7-9)16-17-22-12/h5-8,15H,3-4H2,1-2H3