(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 5-(1,3-benzothiazol-2-yl)furan-2-carboxylate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 5-(1,3-benzothiazol-2-yl)furan-2-carboxylate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 5-(1,3-benzothiazol-2-yl)furan-2-carboxylate CAS Name: 5-(1,3-benzothiazol-2-yl)-2-furancarboxylic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 5-(1,3-benzothiazol-2-yl)furan-2-carboxylate Traditional Name: 5-(1,3-benzothiazol-2-yl)furan-2-carboxylic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C20H12N4O4S MolecularWeight: 404.39868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)C3=CC=C(O3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)C3=CC=C(O3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C20H12N4O4S/c25-19-12-5-1-2-6-13(12)22-23-24(19)11-27-20(26)16-10-9-15(28-16)18-21-14-7-3-4-8-17(14)29-18/h1-10H,11H2