disodium 6-methyl-2-[4-[2-(1-oxidanylidene-4-sulfonato-naphthalen-2-ylidene)hydrazinyl]phenyl]-1,3-benzothiazole-7-sulfonate

Systemtic Name: disodium 6-methyl-2-[4-[2-(1-oxidanylidene-4-sulfonato-naphthalen-2-ylidene)hydrazinyl]phenyl]-1,3-benzothiazole-7-sulfonate Openeye Name: disodium 6-methyl-2-[4-[2-(1-oxo-4-sulfonato-2-naphthylidene)hydrazino]phenyl]-1,3-benzothiazole-7-sulfonate CAS Name: disodium 6-methyl-2-[4-[2-(1-oxo-4-sulfonato-2-naphthalenylidene)hydrazinyl]phenyl]-1,3-benzothiazole-7-sulfonate IUPAC Name: disodium 6-methyl-2-[4-[2-(1-oxo-4-sulfonatonaphthalen-2-ylidene)hydrazinyl]phenyl]-1,3-benzothiazole-7-sulfonate Traditional Name: disodium 2-[4-[N'-(1-keto-4-sulfonato-2-naphthylidene)hydrazino]phenyl]-6-methyl-1,3-benzothiazole-7-sulfonate Formula: C24H15N3Na2O7S3 MolecularWeight: 599.56634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NN=C4C=C(C5=CC=CC=C5C4=O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CC1=C(C2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NN=C4C=C(C5=CC=CC=C5C4=O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C24H17N3O7S3.2Na/c1-13-6-11-18-22(23(13)37(32,33)34)35-24(25-18)14-7-9-15(10-8-14)26-27-19-12-20(36(29,30)31)16-4-2-3-5-17(16)21(19)28;;/h2-12,26H,1H3,(H,29,30,31)(H,32,33,34);;/q;2*+1/p-2