ethyl 1-(6-methoxypyridin-3-yl)-5-[1-(phenylsulfonyl)pyrrol-2-yl]pyrazole-3-carboxylate

Systemtic Name: ethyl 1-(6-methoxypyridin-3-yl)-5-[1-(phenylsulfonyl)pyrrol-2-yl]pyrazole-3-carboxylate Openeye Name: ethyl 5-[1-(benzenesulfonyl)pyrrol-2-yl]-1-(6-methoxy-3-pyridyl)pyrazole-3-carboxylate CAS Name: 5-[1-(benzenesulfonyl)-2-pyrrolyl]-1-(6-methoxy-3-pyridinyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[1-(benzenesulfonyl)pyrrol-2-yl]-1-(6-methoxypyridin-3-yl)pyrazole-3-carboxylate Traditional Name: 5-(1-besylpyrrol-2-yl)-1-(6-methoxy-3-pyridyl)pyrazole-3-carboxylic acid ethyl ester Formula: C22H20N4O5S MolecularWeight: 452.483

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C2=CC=CN2S(=O)(=O)C3=CC=CC=C3)C4=CN=C(C=C4)OC

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C2=CC=CN2S(=O)(=O)C3=CC=CC=C3)C4=CN=C(C=C4)OC

InChI

InChI=1S/C22H20N4O5S/c1-3-31-22(27)18-14-20(26(24-18)16-11-12-21(30-2)23-15-16)19-10-7-13-25(19)32(28,29)17-8-5-4-6-9-17/h4-15H,3H2,1-2H3