2-(4-aminophenyl)-6-methyl-1,3-benzothiazole-7-sulfonic acid; 2-[bis(2-hydroxyethyl)amino]ethanol

Systemtic Name: 2-(4-aminophenyl)-6-methyl-1,3-benzothiazole-7-sulfonic acid; 2-[bis(2-hydroxyethyl)amino]ethanol Openeye Name: 2-(4-aminophenyl)-6-methyl-1,3-benzothiazole-7-sulfonic acid; 2-[bis(2-hydroxyethyl)amino]ethanol CAS Name: 2-(4-aminophenyl)-6-methyl-1,3-benzothiazole-7-sulfonic acid; 2-[bis(2-hydroxyethyl)amino]ethanol IUPAC Name: 2-(4-aminophenyl)-6-methyl-1,3-benzothiazole-7-sulfonic acid; 2-[bis(2-hydroxyethyl)amino]ethanol Traditional Name: 2-(4-aminophenyl)-6-methyl-1,3-benzothiazole-7-sulfonic acid; 2-[bis(2-hydroxyethyl)amino]ethanol Formula: C20H27N3O6S2 MolecularWeight: 469.57488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N)S(=O)(=O)O.C(CO)N(CCO)CCO

Isomeric SMILES

CC1=C(C2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N)S(=O)(=O)O.C(CO)N(CCO)CCO

InChI

InChI=1S/C14H12N2O3S2.C6H15NO3/c1-8-2-7-11-12(13(8)21(17,18)19)20-14(16-11)9-3-5-10(15)6-4-9;8-4-1-7(2-5-9)3-6-10/h2-7H,15H2,1H3,(H,17,18,19);8-10H,1-6H2