methyl 2-azanyl-1,3-benzothiazole-6-sulfonate

Systemtic Name: methyl 2-azanyl-1,3-benzothiazole-6-sulfonate Openeye Name: methyl 2-amino-1,3-benzothiazole-6-sulfonate CAS Name: 2-amino-1,3-benzothiazole-6-sulfonic acid methyl ester IUPAC Name: methyl 2-amino-1,3-benzothiazole-6-sulfonate Traditional Name: 2-amino-1,3-benzothiazole-6-sulfonic acid methyl ester Formula: C8H8N2O3S2 MolecularWeight: 244.29072

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Descriptors Computed from Structure

Canonical SMILES:

COS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)N

Isomeric SMILES

COS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)N

InChI

InChI=1S/C8H8N2O3S2/c1-13-15(11,12)5-2-3-6-7(4-5)14-8(9)10-6/h2-4H,1H3,(H2,9,10)