2-(3,4-dimethoxyphenyl)-1-[4-(2-thiophen-2-ylcyclopropyl)carbonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(3,4-dimethoxyphenyl)-1-[4-(2-thiophen-2-ylcyclopropyl)carbonylpiperazin-1-yl]ethanone Openeye Name: 2-(3,4-dimethoxyphenyl)-1-[4-[2-(2-thienyl)cyclopropanecarbonyl]piperazin-1-yl]ethanone CAS Name: 2-(3,4-dimethoxyphenyl)-1-[4-[oxo-(2-thiophen-2-ylcyclopropyl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-(3,4-dimethoxyphenyl)-1-[4-(2-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]ethanone Traditional Name: 2-(3,4-dimethoxyphenyl)-1-[4-[2-(2-thienyl)cyclopropanecarbonyl]piperazino]ethanone Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)N2CCN(CC2)C(=O)C3CC3C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)N2CCN(CC2)C(=O)C3CC3C4=CC=CS4)OC

InChI

InChI=1S/C22H26N2O4S/c1-27-18-6-5-15(12-19(18)28-2)13-21(25)23-7-9-24(10-8-23)22(26)17-14-16(17)20-4-3-11-29-20/h3-6,11-12,16-17H,7-10,13-14H2,1-2H3