4-(4-butoxyphenyl)-5-(4-methylsulfonylphenyl)-1H-pyrazole

Systemtic Name: 4-(4-butoxyphenyl)-5-(4-methylsulfonylphenyl)-1H-pyrazole Openeye Name: 4-(4-butoxyphenyl)-5-(4-methylsulfonylphenyl)-1H-pyrazole CAS Name: 4-(4-butoxyphenyl)-5-(4-methylsulfonylphenyl)-1H-pyrazole IUPAC Name: 4-(4-butoxyphenyl)-5-(4-methylsulfonylphenyl)-1H-pyrazole Traditional Name: 4-(4-butoxyphenyl)-5-(4-mesylphenyl)-1H-pyrazole Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=C(NN=C2)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=C(NN=C2)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C20H22N2O3S/c1-3-4-13-25-17-9-5-15(6-10-17)19-14-21-22-20(19)16-7-11-18(12-8-16)26(2,23)24/h5-12,14H,3-4,13H2,1-2H3,(H,21,22)