2-(3,4-dimethoxyphenyl)sulfanyl-1-[2-(1-phenylcyclopropyl)carbonylpyrazolidin-1-yl]ethanone

Systemtic Name: 2-(3,4-dimethoxyphenyl)sulfanyl-1-[2-(1-phenylcyclopropyl)carbonylpyrazolidin-1-yl]ethanone Openeye Name: 2-(3,4-dimethoxyphenyl)sulfanyl-1-[2-(1-phenylcyclopropanecarbonyl)pyrazolidin-1-yl]ethanone CAS Name: 2-[(3,4-dimethoxyphenyl)thio]-1-[2-[oxo-(1-phenylcyclopropyl)methyl]-1-pyrazolidinyl]ethanone IUPAC Name: 2-(3,4-dimethoxyphenyl)sulfanyl-1-[2-(1-phenylcyclopropanecarbonyl)pyrazolidin-1-yl]ethanone Traditional Name: 2-[(3,4-dimethoxyphenyl)thio]-1-[2-(1-phenylcyclopropanecarbonyl)pyrazolidin-1-yl]ethanone Formula: C23H26N2O4S MolecularWeight: 426.52854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SCC(=O)N2CCCN2C(=O)C3(CC3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)SCC(=O)N2CCCN2C(=O)C3(CC3)C4=CC=CC=C4)OC

InChI

InChI=1S/C23H26N2O4S/c1-28-19-10-9-18(15-20(19)29-2)30-16-21(26)24-13-6-14-25(24)22(27)23(11-12-23)17-7-4-3-5-8-17/h3-5,7-10,15H,6,11-14,16H2,1-2H3