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

Systemtic Name: 1-(4-chlorophenyl)-4-[4-(2-thiophen-2-ylcyclopropyl)carbonylpiperazin-1-yl]butane-1,4-dione Openeye Name: 1-(4-chlorophenyl)-4-[4-[2-(2-thienyl)cyclopropanecarbonyl]piperazin-1-yl]butane-1,4-dione CAS Name: 1-(4-chlorophenyl)-4-[4-[oxo-(2-thiophen-2-ylcyclopropyl)methyl]-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(4-chlorophenyl)-4-[4-(2-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]butane-1,4-dione Traditional Name: 1-(4-chlorophenyl)-4-[4-[2-(2-thienyl)cyclopropanecarbonyl]piperazino]butane-1,4-dione Formula: C22H23ClN2O3S MolecularWeight: 430.94762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23ClN2O3S/c23-16-5-3-15(4-6-16)19(26)7-8-21(27)24-9-11-25(12-10-24)22(28)18-14-17(18)20-2-1-13-29-20/h1-6,13,17-18H,7-12,14H2