(E)-3-(4-phenylmethoxyphenyl)-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(4-phenylmethoxyphenyl)-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(4-benzyloxyphenyl)-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-1-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-3-(4-phenylmethoxyphenyl)-2-propen-1-one IUPAC Name: (E)-3-(4-phenylmethoxyphenyl)-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(4-benzoxyphenyl)-1-[4-(2-thenoyl)piperazino]prop-2-en-1-one Formula: C25H24N2O3S MolecularWeight: 432.53466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C=CC2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)/C=C/C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)C4=CC=CS4

InChI

InChI=1S/C25H24N2O3S/c28-24(26-14-16-27(17-15-26)25(29)23-7-4-18-31-23)13-10-20-8-11-22(12-9-20)30-19-21-5-2-1-3-6-21/h1-13,18H,14-17,19H2/b13-10+