(E)-3-(3,4-dimethoxyphenyl)-1-[4-(2-thiophen-2-ylcyclopropyl)carbonylpiperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(3,4-dimethoxyphenyl)-1-[4-(2-thiophen-2-ylcyclopropyl)carbonylpiperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(3,4-dimethoxyphenyl)-1-[4-[2-(2-thienyl)cyclopropanecarbonyl]piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(3,4-dimethoxyphenyl)-1-[4-[oxo-(2-thiophen-2-ylcyclopropyl)methyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(3,4-dimethoxyphenyl)-1-[4-(2-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(3,4-dimethoxyphenyl)-1-[4-[2-(2-thienyl)cyclopropanecarbonyl]piperazino]prop-2-en-1-one Formula: C23H26N2O4S MolecularWeight: 426.52854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)N2CCN(CC2)C(=O)C3CC3C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)N2CCN(CC2)C(=O)C3CC3C4=CC=CS4)OC

InChI

InChI=1S/C23H26N2O4S/c1-28-19-7-5-16(14-20(19)29-2)6-8-22(26)24-9-11-25(12-10-24)23(27)18-15-17(18)21-4-3-13-30-21/h3-8,13-14,17-18H,9-12,15H2,1-2H3/b8-6+