azanium 2-(4-aminophenyl)-6-methyl-1,3-benzothiazole-5-sulfonate

Systemtic Name: azanium 2-(4-aminophenyl)-6-methyl-1,3-benzothiazole-5-sulfonate Openeye Name: ammonium 2-(4-aminophenyl)-6-methyl-1,3-benzothiazole-5-sulfonate CAS Name: ammonium 2-(4-aminophenyl)-6-methyl-1,3-benzothiazole-5-sulfonate IUPAC Name: azanium 2-(4-aminophenyl)-6-methyl-1,3-benzothiazole-5-sulfonate Traditional Name: ammonium 2-(4-aminophenyl)-6-methyl-1,3-benzothiazole-5-sulfonate Formula: C14H15N3O3S2 MolecularWeight: 337.4172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1S(=O)(=O)[O-])N=C(S2)C3=CC=C(C=C3)N.[NH4+]

Isomeric SMILES

CC1=CC2=C(C=C1S(=O)(=O)[O-])N=C(S2)C3=CC=C(C=C3)N.[NH4+]

InChI

InChI=1S/C14H12N2O3S2.H3N/c1-8-6-12-11(7-13(8)21(17,18)19)16-14(20-12)9-2-4-10(15)5-3-9;/h2-7H,15H2,1H3,(H,17,18,19);1H3