4-[[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-methyl-5-oxidanylidene-4H-pyrazol-4-yl]diazenyl]naphthalene-1-sulfonic acid

Systemtic Name: 4-[[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-methyl-5-oxidanylidene-4H-pyrazol-4-yl]diazenyl]naphthalene-1-sulfonic acid Openeye Name: 4-[[1-[4-(4-bromophenyl)thiazol-2-yl]-3-methyl-5-oxo-4H-pyrazol-4-yl]azo]naphthalene-1-sulfonic acid CAS Name: 4-[[1-[4-(4-bromophenyl)-2-thiazolyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]azo]-1-naphthalenesulfonic acid IUPAC Name: 4-[[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]naphthalene-1-sulfonic acid Traditional Name: 4-[[1-[4-(4-bromophenyl)thiazol-2-yl]-5-keto-3-methyl-2-pyrazolin-4-yl]azo]naphthalene-1-sulfonic acid Formula: C23H16BrN5O4S2 MolecularWeight: 570.43824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1N=NC2=CC=C(C3=CC=CC=C32)S(=O)(=O)O)C4=NC(=CS4)C5=CC=C(C=C5)Br

Isomeric SMILES

CC1=NN(C(=O)C1N=NC2=CC=C(C3=CC=CC=C32)S(=O)(=O)O)C4=NC(=CS4)C5=CC=C(C=C5)Br

InChI

InChI=1S/C23H16BrN5O4S2/c1-13-21(27-26-18-10-11-20(35(31,32)33)17-5-3-2-4-16(17)18)22(30)29(28-13)23-25-19(12-34-23)14-6-8-15(24)9-7-14/h2-12,21H,1H3,(H,31,32,33)