3-[4-methoxy-3-(oxolan-2-yloxy)phenyl]-1-(phenylmethyl)sulfonyl-pyrazole

Systemtic Name: 3-[4-methoxy-3-(oxolan-2-yloxy)phenyl]-1-(phenylmethyl)sulfonyl-pyrazole Openeye Name: 1-benzylsulfonyl-3-(4-methoxy-3-tetrahydrofuran-2-yloxy-phenyl)pyrazole CAS Name: 3-[4-methoxy-3-(2-oxolanyloxy)phenyl]-1-(phenylmethyl)sulfonylpyrazole IUPAC Name: 1-benzylsulfonyl-3-[4-methoxy-3-(oxolan-2-yloxy)phenyl]pyrazole Traditional Name: 1-benzylsulfonyl-3-[4-methoxy-3-(tetrahydrofuryloxy)phenyl]pyrazole Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2)S(=O)(=O)CC3=CC=CC=C3)OC4CCCO4

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2)S(=O)(=O)CC3=CC=CC=C3)OC4CCCO4

InChI

InChI=1S/C21H22N2O5S/c1-26-19-10-9-17(14-20(19)28-21-8-5-13-27-21)18-11-12-23(22-18)29(24,25)15-16-6-3-2-4-7-16/h2-4,6-7,9-12,14,21H,5,8,13,15H2,1H3