2-[(2R)-1-(4-chloranylpyrazol-1-yl)propan-2-yl]-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[(2R)-1-(4-chloranylpyrazol-1-yl)propan-2-yl]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[(1R)-2-(4-chloropyrazol-1-yl)-1-methyl-ethyl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[(2R)-1-(4-chloro-1-pyrazolyl)propan-2-yl]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[(2R)-1-(4-chloropyrazol-1-yl)propan-2-yl]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[(1R)-2-(4-chloropyrazol-1-yl)-1-methyl-ethyl]-4-methyl-thiazole-5-carboxylic acid Formula: C11H12ClN3O2S MolecularWeight: 285.74988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C(C)CN2C=C(C=N2)Cl)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)[C@H](C)CN2C=C(C=N2)Cl)C(=O)O

InChI

InChI=1S/C11H12ClN3O2S/c1-6(4-15-5-8(12)3-13-15)10-14-7(2)9(18-10)11(16)17/h3,5-6H,4H2,1-2H3,(H,16,17)/t6-/m1/s1