methyl 1-(5-methylsulfonylpyridin-2-yl)-5-[3-methyl-4-(1,3-thiazol-4-yl)phenyl]pyrazole-3-carboxylate

Systemtic Name: methyl 1-(5-methylsulfonylpyridin-2-yl)-5-[3-methyl-4-(1,3-thiazol-4-yl)phenyl]pyrazole-3-carboxylate Openeye Name: methyl 1-(5-methylsulfonyl-2-pyridyl)-5-(3-methyl-4-thiazol-4-yl-phenyl)pyrazole-3-carboxylate CAS Name: 1-(5-methylsulfonyl-2-pyridinyl)-5-[3-methyl-4-(4-thiazolyl)phenyl]-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-(5-methylsulfonylpyridin-2-yl)-5-[3-methyl-4-(1,3-thiazol-4-yl)phenyl]pyrazole-3-carboxylate Traditional Name: 1-(5-mesyl-2-pyridyl)-5-(3-methyl-4-thiazol-4-yl-phenyl)pyrazole-3-carboxylic acid methyl ester Formula: C21H18N4O4S2 MolecularWeight: 454.52202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC(=NN2C3=NC=C(C=C3)S(=O)(=O)C)C(=O)OC)C4=CSC=N4

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC(=NN2C3=NC=C(C=C3)S(=O)(=O)C)C(=O)OC)C4=CSC=N4

InChI

InChI=1S/C21H18N4O4S2/c1-13-8-14(4-6-16(13)18-11-30-12-23-18)19-9-17(21(26)29-2)24-25(19)20-7-5-15(10-22-20)31(3,27)28/h4-12H,1-3H3