1-phenyl-4-[4-(2-thiophen-2-ylcyclopropyl)carbonylpiperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-phenyl-4-[4-(2-thiophen-2-ylcyclopropyl)carbonylpiperazin-1-yl]butane-1,4-dione Openeye Name: 1-phenyl-4-[4-[2-(2-thienyl)cyclopropanecarbonyl]piperazin-1-yl]butane-1,4-dione CAS Name: 1-[4-[oxo-(2-thiophen-2-ylcyclopropyl)methyl]-1-piperazinyl]-4-phenylbutane-1,4-dione IUPAC Name: 1-phenyl-4-[4-(2-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]butane-1,4-dione Traditional Name: 1-phenyl-4-[4-[2-(2-thienyl)cyclopropanecarbonyl]piperazino]butane-1,4-dione Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O3S/c25-19(16-5-2-1-3-6-16)8-9-21(26)23-10-12-24(13-11-23)22(27)18-15-17(18)20-7-4-14-28-20/h1-7,14,17-18H,8-13,15H2