4-[[(4R)-1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-methyl-5-oxidanylidene-4H-pyrazol-4-yl]diazenyl]benzenesulfonate

Systemtic Name: 4-[[(4R)-1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-methyl-5-oxidanylidene-4H-pyrazol-4-yl]diazenyl]benzenesulfonate Openeye Name: 4-[[(4R)-1-[4-(4-methoxyphenyl)thiazol-2-yl]-3-methyl-5-oxo-4H-pyrazol-4-yl]azo]benzenesulfonate CAS Name: 4-[[(4R)-1-[4-(4-methoxyphenyl)-2-thiazolyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]azo]benzenesulfonate IUPAC Name: 4-[[(4R)-1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzenesulfonate Traditional Name: 4-[[(4R)-5-keto-1-[4-(4-methoxyphenyl)thiazol-2-yl]-3-methyl-2-pyrazolin-4-yl]azo]besylate Formula: C20H16N5O5S2- MolecularWeight: 470.50154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)S(=O)(=O)[O-])C3=NC(=CS3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=NN(C(=O)[C@@H]1N=NC2=CC=C(C=C2)S(=O)(=O)[O-])C3=NC(=CS3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C20H17N5O5S2/c1-12-18(23-22-14-5-9-16(10-6-14)32(27,28)29)19(26)25(24-12)20-21-17(11-31-20)13-3-7-15(30-2)8-4-13/h3-11,18H,1-2H3,(H,27,28,29)/p-1/t18-/m1/s1