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

Systemtic Name: 3,3-diphenyl-1-[4-(2-thiophen-2-ylcyclopropyl)carbonylpiperazin-1-yl]propan-1-one Openeye Name: 3,3-diphenyl-1-[4-[2-(2-thienyl)cyclopropanecarbonyl]piperazin-1-yl]propan-1-one CAS Name: 1-[4-[oxo-(2-thiophen-2-ylcyclopropyl)methyl]-1-piperazinyl]-3,3-diphenyl-1-propanone IUPAC Name: 3,3-diphenyl-1-[4-(2-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]propan-1-one Traditional Name: 3,3-diphenyl-1-[4-[2-(2-thienyl)cyclopropanecarbonyl]piperazino]propan-1-one Formula: C27H28N2O2S MolecularWeight: 444.58842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4CC4C5=CC=CS5

Isomeric SMILES

C1CN(CCN1C(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4CC4C5=CC=CS5

InChI

InChI=1S/C27H28N2O2S/c30-26(19-22(20-8-3-1-4-9-20)21-10-5-2-6-11-21)28-13-15-29(16-14-28)27(31)24-18-23(24)25-12-7-17-32-25/h1-12,17,22-24H,13-16,18-19H2