(E)-1-(4-bromanylthiophen-2-yl)-3-(1-ethyl-5-methyl-pyrazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-bromanylthiophen-2-yl)-3-(1-ethyl-5-methyl-pyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-1-(4-bromo-2-thienyl)-3-(1-ethyl-5-methyl-pyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-1-(4-bromo-2-thiophenyl)-3-(1-ethyl-5-methyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-1-(4-bromothiophen-2-yl)-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-1-(4-bromo-2-thienyl)-3-(1-ethyl-5-methyl-pyrazol-4-yl)prop-2-en-1-one Formula: C13H13BrN2OS MolecularWeight: 325.22412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)C=CC(=O)C2=CC(=CS2)Br)C

Isomeric SMILES

CCN1C(=C(C=N1)/C=C/C(=O)C2=CC(=CS2)Br)C

InChI

InChI=1S/C13H13BrN2OS/c1-3-16-9(2)10(7-15-16)4-5-12(17)13-6-11(14)8-18-13/h4-8H,3H2,1-2H3/b5-4+