5-(3,4-dimethoxyphenyl)-2-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-4,4-dimethyl-pyrazol-3-one

Systemtic Name: 5-(3,4-dimethoxyphenyl)-2-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-4,4-dimethyl-pyrazol-3-one Openeye Name: 5-(3,4-dimethoxyphenyl)-2-[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]-4,4-dimethyl-pyrazol-3-one CAS Name: 5-(3,4-dimethoxyphenyl)-2-[1-(4-methoxyphenyl)sulfonyl-4-piperidinyl]-4,4-dimethyl-3-pyrazolone IUPAC Name: 5-(3,4-dimethoxyphenyl)-2-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-4,4-dimethylpyrazol-3-one Traditional Name: 5-(3,4-dimethoxyphenyl)-2-[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]-4,4-dimethyl-2-pyrazolin-3-one Formula: C25H31N3O6S MolecularWeight: 501.59514

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=NN(C1=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC)C4=CC(=C(C=C4)OC)OC)C

Isomeric SMILES

CC1(C(=NN(C1=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC)C4=CC(=C(C=C4)OC)OC)C

InChI

InChI=1S/C25H31N3O6S/c1-25(2)23(17-6-11-21(33-4)22(16-17)34-5)26-28(24(25)29)18-12-14-27(15-13-18)35(30,31)20-9-7-19(32-3)8-10-20/h6-11,16,18H,12-15H2,1-5H3