(E)-3-(5-bromanylthiophen-2-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(5-bromanylthiophen-2-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(5-bromo-2-thienyl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one CAS Name: (E)-3-(5-bromo-2-thiophenyl)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(5-bromothiophen-2-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)prop-2-en-1-one Traditional Name: (E)-3-(5-bromo-2-thienyl)-1-[4-(2-pyrimidyl)piperazino]prop-2-en-1-one Formula: C15H15BrN4OS MolecularWeight: 379.2748

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C=CC3=CC=C(S3)Br

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)/C=C/C3=CC=C(S3)Br

InChI

InChI=1S/C15H15BrN4OS/c16-13-4-2-12(22-13)3-5-14(21)19-8-10-20(11-9-19)15-17-6-1-7-18-15/h1-7H,8-11H2/b5-3+