azane; 2-azanyl-5-(6-methyl-1,3-benzothiazol-2-yl)benzenesulfonic acid

Systemtic Name: azane; 2-azanyl-5-(6-methyl-1,3-benzothiazol-2-yl)benzenesulfonic acid Openeye Name: 2-amino-5-(6-methyl-1,3-benzothiazol-2-yl)benzenesulfonic acid; ammonia CAS Name: 2-amino-5-(6-methyl-1,3-benzothiazol-2-yl)benzenesulfonic acid; ammonia IUPAC Name: 2-amino-5-(6-methyl-1,3-benzothiazol-2-yl)benzenesulfonic acid; azane Traditional Name: 2-amino-5-(6-methyl-1,3-benzothiazol-2-yl)besylic acid; ammonia Formula: C14H15N3O3S2 MolecularWeight: 337.4172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC(=C(C=C3)N)S(=O)(=O)O.N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC(=C(C=C3)N)S(=O)(=O)O.N

InChI

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