1-[(3S)-3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-(2-methoxyphenoxy)ethanone

Systemtic Name: 1-[(3S)-3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-(2-methoxyphenoxy)ethanone Openeye Name: 1-[(3S)-3-(3,4-dimethoxyphenyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-(2-methoxyphenoxy)ethanone CAS Name: 1-[(3S)-3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-(2-methoxyphenoxy)ethanone IUPAC Name: 1-[(3S)-3-(3,4-dimethoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-(2-methoxyphenoxy)ethanone Traditional Name: 1-[(5S)-5-(3,4-dimethoxyphenyl)-3-(2-thienyl)-2-pyrazolin-1-yl]-2-(2-methoxyphenoxy)ethanone Formula: C24H24N2O5S MolecularWeight: 452.52276

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(=NN2C(=O)COC3=CC=CC=C3OC)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@H]2CC(=NN2C(=O)COC3=CC=CC=C3OC)C4=CC=CS4)OC

InChI

InChI=1S/C24H24N2O5S/c1-28-19-7-4-5-8-21(19)31-15-24(27)26-18(14-17(25-26)23-9-6-12-32-23)16-10-11-20(29-2)22(13-16)30-3/h4-13,18H,14-15H2,1-3H3/t18-/m0/s1