(3-morpholin-4-ylsulfonylphenyl)methyl 5-methyl-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 5-methyl-1-phenyl-pyrazole-4-carboxylate Openeye Name: (3-morpholinosulfonylphenyl)methyl 5-methyl-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-methyl-1-phenyl-4-pyrazolecarboxylic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 5-methyl-1-phenylpyrazole-4-carboxylate Traditional Name: 5-methyl-1-phenyl-pyrazole-4-carboxylic acid (3-morpholinosulfonylbenzyl) ester Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(=O)OCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)C(=O)OCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H23N3O5S/c1-17-21(15-23-25(17)19-7-3-2-4-8-19)22(26)30-16-18-6-5-9-20(14-18)31(27,28)24-10-12-29-13-11-24/h2-9,14-15H,10-13,16H2,1H3