dimethyl 2-azanyl-1,3-benzothiazole-5,7-dicarboxylate

Systemtic Name: dimethyl 2-azanyl-1,3-benzothiazole-5,7-dicarboxylate Openeye Name: dimethyl 2-amino-1,3-benzothiazole-5,7-dicarboxylate CAS Name: 2-amino-1,3-benzothiazole-5,7-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-amino-1,3-benzothiazole-5,7-dicarboxylate Traditional Name: 2-amino-1,3-benzothiazole-5,7-dicarboxylic acid dimethyl ester Formula: C11H10N2O4S MolecularWeight: 266.2731

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C2C(=C1)N=C(S2)N)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=C2C(=C1)N=C(S2)N)C(=O)OC

InChI

InChI=1S/C11H10N2O4S/c1-16-9(14)5-3-6(10(15)17-2)8-7(4-5)13-11(12)18-8/h3-4H,1-2H3,(H2,12,13)