3-azanyl-7-methyl-2,1-benzothiazole-5-sulfonate

Systemtic Name: 3-azanyl-7-methyl-2,1-benzothiazole-5-sulfonate Openeye Name: 3-amino-7-methyl-2,1-benzothiazole-5-sulfonate CAS Name: 3-amino-7-methyl-2,1-benzothiazole-5-sulfonate IUPAC Name: 3-amino-7-methyl-2,1-benzothiazole-5-sulfonate Traditional Name: 3-amino-7-methyl-2,1-benzothiazole-5-sulfonate Formula: C8H7N2O3S2- MolecularWeight: 243.28278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C(SN=C12)N)S(=O)(=O)[O-]

Isomeric SMILES

CC1=CC(=CC2=C(SN=C12)N)S(=O)(=O)[O-]

InChI

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