(2E)-2-[(4-fluorophenyl)methylidene]-4-(4-phenylpiperazin-1-yl)-1-thiophen-2-yl-butan-1-one

Systemtic Name: (2E)-2-[(4-fluorophenyl)methylidene]-4-(4-phenylpiperazin-1-yl)-1-thiophen-2-yl-butan-1-one Openeye Name: (2E)-2-[(4-fluorophenyl)methylene]-4-(4-phenylpiperazin-1-yl)-1-(2-thienyl)butan-1-one CAS Name: (2E)-2-[(4-fluorophenyl)methylidene]-4-(4-phenyl-1-piperazinyl)-1-thiophen-2-yl-1-butanone IUPAC Name: (2E)-2-[(4-fluorophenyl)methylidene]-4-(4-phenylpiperazin-1-yl)-1-thiophen-2-ylbutan-1-one Traditional Name: (E)-3-(4-fluorophenyl)-2-[2-(4-phenylpiperazino)ethyl]-1-(2-thienyl)prop-2-en-1-one Formula: C25H25FN2OS MolecularWeight: 420.542203

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=CC2=CC=C(C=C2)F)C(=O)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC/C(=C\C2=CC=C(C=C2)F)/C(=O)C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C25H25FN2OS/c26-22-10-8-20(9-11-22)19-21(25(29)24-7-4-18-30-24)12-13-27-14-16-28(17-15-27)23-5-2-1-3-6-23/h1-11,18-19H,12-17H2/b21-19+