5-methyl-2-[4-[[4-(5-methyl-4-sulfonato-1,3-benzothiazol-2-yl)phenyl]diazenyl]phenyl]-1,3-benzothiazole-4-sulfonate

Systemtic Name: 5-methyl-2-[4-[[4-(5-methyl-4-sulfonato-1,3-benzothiazol-2-yl)phenyl]diazenyl]phenyl]-1,3-benzothiazole-4-sulfonate Openeye Name: 5-methyl-2-[4-[4-(5-methyl-4-sulfonato-1,3-benzothiazol-2-yl)phenyl]azophenyl]-1,3-benzothiazole-4-sulfonate CAS Name: 5-methyl-2-[4-[4-(5-methyl-4-sulfonato-1,3-benzothiazol-2-yl)phenyl]azophenyl]-1,3-benzothiazole-4-sulfonate IUPAC Name: 5-methyl-2-[4-[[4-(5-methyl-4-sulfonato-1,3-benzothiazol-2-yl)phenyl]diazenyl]phenyl]-1,3-benzothiazole-4-sulfonate Traditional Name: 5-methyl-2-[4-[4-(5-methyl-4-sulfonato-1,3-benzothiazol-2-yl)phenyl]azophenyl]-1,3-benzothiazole-4-sulfonate Formula: C28H18N4O6S4-2 MolecularWeight: 634.72572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)SC(=N2)C3=CC=C(C=C3)N=NC4=CC=C(C=C4)C5=NC6=C(S5)C=CC(=C6S(=O)(=O)[O-])C)S(=O)(=O)[O-]

Isomeric SMILES

CC1=C(C2=C(C=C1)SC(=N2)C3=CC=C(C=C3)N=NC4=CC=C(C=C4)C5=NC6=C(S5)C=CC(=C6S(=O)(=O)[O-])C)S(=O)(=O)[O-]

InChI

InChI=1S/C28H20N4O6S4/c1-15-3-13-21-23(25(15)41(33,34)35)29-27(39-21)17-5-9-19(10-6-17)31-32-20-11-7-18(8-12-20)28-30-24-22(40-28)14-4-16(2)26(24)42(36,37)38/h3-14H,1-2H3,(H,33,34,35)(H,36,37,38)/p-2