ethyl 5-cyclopropyl-1-(2-methylsulfonylphenyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 5-cyclopropyl-1-(2-methylsulfonylphenyl)pyrazole-4-carboxylate Openeye Name: ethyl 5-cyclopropyl-1-(2-methylsulfonylphenyl)pyrazole-4-carboxylate CAS Name: 5-cyclopropyl-1-(2-methylsulfonylphenyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyclopropyl-1-(2-methylsulfonylphenyl)pyrazole-4-carboxylate Traditional Name: 5-cyclopropyl-1-(2-mesylphenyl)pyrazole-4-carboxylic acid ethyl ester Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2S(=O)(=O)C)C3CC3

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2S(=O)(=O)C)C3CC3

InChI

InChI=1S/C16H18N2O4S/c1-3-22-16(19)12-10-17-18(15(12)11-8-9-11)13-6-4-5-7-14(13)23(2,20)21/h4-7,10-11H,3,8-9H2,1-2H3