(Z)-3-(4-fluorophenyl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-thiophen-2-yl-prop-2-en-1-one

Systemtic Name: (Z)-3-(4-fluorophenyl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-thiophen-2-yl-prop-2-en-1-one Openeye Name: (Z)-3-(4-fluorophenyl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-(2-thienyl)prop-2-en-1-one CAS Name: (Z)-3-(4-fluorophenyl)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-2-thiophen-2-yl-2-propen-1-one IUPAC Name: (Z)-3-(4-fluorophenyl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-thiophen-2-ylprop-2-en-1-one Traditional Name: (Z)-3-(4-fluorophenyl)-1-[4-(2-pyrimidyl)piperazino]-2-(2-thienyl)prop-2-en-1-one Formula: C21H19FN4OS MolecularWeight: 394.465163

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C(=CC3=CC=C(C=C3)F)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)/C(=C/C3=CC=C(C=C3)F)/C4=CC=CS4

InChI

InChI=1S/C21H19FN4OS/c22-17-6-4-16(5-7-17)15-18(19-3-1-14-28-19)20(27)25-10-12-26(13-11-25)21-23-8-2-9-24-21/h1-9,14-15H,10-13H2/b18-15+