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

Systemtic Name: 2-[[(4R)-1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-methyl-5-oxidanylidene-4H-pyrazol-4-yl]diazenyl]benzoate Openeye Name: 2-[[(4R)-1-[4-(4-methoxyphenyl)thiazol-2-yl]-3-methyl-5-oxo-4H-pyrazol-4-yl]azo]benzoate CAS Name: 2-[[(4R)-1-[4-(4-methoxyphenyl)-2-thiazolyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]azo]benzoate IUPAC Name: 2-[[(4R)-1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoate Traditional Name: 2-[[(4R)-5-keto-1-[4-(4-methoxyphenyl)thiazol-2-yl]-3-methyl-2-pyrazolin-4-yl]azo]benzoate Formula: C21H16N5O4S- MolecularWeight: 434.44784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1N=NC2=CC=CC=C2C(=O)[O-])C3=NC(=CS3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=NN(C(=O)[C@@H]1N=NC2=CC=CC=C2C(=O)[O-])C3=NC(=CS3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C21H17N5O4S/c1-12-18(24-23-16-6-4-3-5-15(16)20(28)29)19(27)26(25-12)21-22-17(11-31-21)13-7-9-14(30-2)10-8-13/h3-11,18H,1-2H3,(H,28,29)/p-1/t18-/m1/s1