3-phenylsulfanyl-1-[4-(2-thiophen-2-ylcyclopropyl)carbonylpiperazin-1-yl]propan-1-one

Systemtic Name: 3-phenylsulfanyl-1-[4-(2-thiophen-2-ylcyclopropyl)carbonylpiperazin-1-yl]propan-1-one Openeye Name: 3-phenylsulfanyl-1-[4-[2-(2-thienyl)cyclopropanecarbonyl]piperazin-1-yl]propan-1-one CAS Name: 1-[4-[oxo-(2-thiophen-2-ylcyclopropyl)methyl]-1-piperazinyl]-3-(phenylthio)-1-propanone IUPAC Name: 3-phenylsulfanyl-1-[4-(2-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(phenylthio)-1-[4-[2-(2-thienyl)cyclopropanecarbonyl]piperazino]propan-1-one Formula: C21H24N2O2S2 MolecularWeight: 400.55746

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCSC2=CC=CC=C2)C(=O)C3CC3C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)CCSC2=CC=CC=C2)C(=O)C3CC3C4=CC=CS4

InChI

InChI=1S/C21H24N2O2S2/c24-20(8-14-26-16-5-2-1-3-6-16)22-9-11-23(12-10-22)21(25)18-15-17(18)19-7-4-13-27-19/h1-7,13,17-18H,8-12,14-15H2