(E)-3-(3,5-dimethoxyphenyl)-1-[4-(2-phenylsulfanylethyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(3,5-dimethoxyphenyl)-1-[4-(2-phenylsulfanylethyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(3,5-dimethoxyphenyl)-1-[4-(2-phenylsulfanylethyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(3,5-dimethoxyphenyl)-1-[4-[2-(phenylthio)ethyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(3,5-dimethoxyphenyl)-1-[4-(2-phenylsulfanylethyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(3,5-dimethoxyphenyl)-1-[4-[2-(phenylthio)ethyl]piperazino]prop-2-en-1-one Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C=CC(=O)N2CCN(CC2)CCSC3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)/C=C/C(=O)N2CCN(CC2)CCSC3=CC=CC=C3)OC

InChI

InChI=1S/C23H28N2O3S/c1-27-20-16-19(17-21(18-20)28-2)8-9-23(26)25-12-10-24(11-13-25)14-15-29-22-6-4-3-5-7-22/h3-9,16-18H,10-15H2,1-2H3/b9-8+