2-[2-chloranyl-5-[4-methyl-2-(1H-pyrazol-5-ylmethyl)-1,3-thiazol-5-yl]phenyl]sulfonylethanol

Systemtic Name: 2-[2-chloranyl-5-[4-methyl-2-(1H-pyrazol-5-ylmethyl)-1,3-thiazol-5-yl]phenyl]sulfonylethanol Openeye Name: 2-[2-chloro-5-[4-methyl-2-(1H-pyrazol-5-ylmethyl)thiazol-5-yl]phenyl]sulfonylethanol CAS Name: 2-[2-chloro-5-[4-methyl-2-(1H-pyrazol-5-ylmethyl)-5-thiazolyl]phenyl]sulfonylethanol IUPAC Name: 2-[2-chloro-5-[4-methyl-2-(1H-pyrazol-5-ylmethyl)-1,3-thiazol-5-yl]phenyl]sulfonylethanol Traditional Name: 2-[2-chloro-5-[4-methyl-2-(1H-pyrazol-5-ylmethyl)thiazol-5-yl]phenyl]sulfonylethanol Formula: C16H16ClN3O3S2 MolecularWeight: 397.89954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)CC2=CC=NN2)C3=CC(=C(C=C3)Cl)S(=O)(=O)CCO

Isomeric SMILES

CC1=C(SC(=N1)CC2=CC=NN2)C3=CC(=C(C=C3)Cl)S(=O)(=O)CCO

InChI

InChI=1S/C16H16ClN3O3S2/c1-10-16(24-15(19-10)9-12-4-5-18-20-12)11-2-3-13(17)14(8-11)25(22,23)7-6-21/h2-5,8,21H,6-7,9H2,1H3,(H,18,20)