(6Z)-4-[(4-chloranyl-6-phenylazanyl-1,3,5-triazin-2-yl)amino]-6-[(2-methylphenyl)hydrazinylidene]-5-oxidanylidene-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid

Systemtic Name: (6Z)-4-[(4-chloranyl-6-phenylazanyl-1,3,5-triazin-2-yl)amino]-6-[(2-methylphenyl)hydrazinylidene]-5-oxidanylidene-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid Openeye Name: (6Z)-4-[(4-anilino-6-chloro-1,3,5-triazin-2-yl)amino]-6-(o-tolylhydrazono)-5-oxo-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid CAS Name: (6Z)-4-[(4-anilino-6-chloro-1,3,5-triazin-2-yl)amino]-6-[(2-methylphenyl)hydrazinylidene]-5-oxo-7-(trioxidanylthio)-2-naphthalenesulfonic acid IUPAC Name: (6Z)-4-[(4-anilino-6-chloro-1,3,5-triazin-2-yl)amino]-6-[(2-methylphenyl)hydrazinylidene]-5-oxo-7-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid Traditional Name: (6Z)-4-[(4-anilino-6-chloro-s-triazin-2-yl)amino]-5-keto-6-(o-tolylhydrazono)-7-(trioxidanylthio)naphthalene-2-sulfonic acid Formula: C26H20ClN7O7S2 MolecularWeight: 642.0627

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NN=C2C(=CC3=CC(=CC(=C3C2=O)NC4=NC(=NC(=N4)NC5=CC=CC=C5)Cl)S(=O)(=O)O)SOOO

Isomeric SMILES

CC1=CC=CC=C1N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)NC4=NC(=NC(=N4)NC5=CC=CC=C5)Cl)S(=O)(=O)O)SOOO

InChI

InChI=1S/C26H20ClN7O7S2/c1-14-7-5-6-10-18(14)33-34-22-20(42-41-40-36)12-15-11-17(43(37,38)39)13-19(21(15)23(22)35)29-26-31-24(27)30-25(32-26)28-16-8-3-2-4-9-16/h2-13,33,36H,1H3,(H,37,38,39)(H2,28,29,30,31,32)/b34-22+