2-(4-propan-2-ylsulfanylphenyl)-1-[4-(2-thiophen-2-ylcyclopropyl)carbonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(4-propan-2-ylsulfanylphenyl)-1-[4-(2-thiophen-2-ylcyclopropyl)carbonylpiperazin-1-yl]ethanone Openeye Name: 2-(4-isopropylsulfanylphenyl)-1-[4-[2-(2-thienyl)cyclopropanecarbonyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[oxo-(2-thiophen-2-ylcyclopropyl)methyl]-1-piperazinyl]-2-[4-(propan-2-ylthio)phenyl]ethanone IUPAC Name: 2-(4-propan-2-ylsulfanylphenyl)-1-[4-(2-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]ethanone Traditional Name: 2-[4-(isopropylthio)phenyl]-1-[4-[2-(2-thienyl)cyclopropanecarbonyl]piperazino]ethanone Formula: C23H28N2O2S2 MolecularWeight: 428.61062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=C(C=C1)CC(=O)N2CCN(CC2)C(=O)C3CC3C4=CC=CS4

Isomeric SMILES

CC(C)SC1=CC=C(C=C1)CC(=O)N2CCN(CC2)C(=O)C3CC3C4=CC=CS4

InChI

InChI=1S/C23H28N2O2S2/c1-16(2)29-18-7-5-17(6-8-18)14-22(26)24-9-11-25(12-10-24)23(27)20-15-19(20)21-4-3-13-28-21/h3-8,13,16,19-20H,9-12,14-15H2,1-2H3