(E)-3-[4,5-bis(bromanyl)thiophen-2-yl]-1-(1-methylpyrazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-3-[4,5-bis(bromanyl)thiophen-2-yl]-1-(1-methylpyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-3-(4,5-dibromo-2-thienyl)-1-(1-methylpyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-3-(4,5-dibromo-2-thiophenyl)-1-(1-methyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-3-(4,5-dibromothiophen-2-yl)-1-(1-methylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-3-(4,5-dibromo-2-thienyl)-1-(1-methylpyrazol-4-yl)prop-2-en-1-one Formula: C11H8Br2N2OS MolecularWeight: 376.06702

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(=O)C=CC2=CC(=C(S2)Br)Br

Isomeric SMILES

CN1C=C(C=N1)C(=O)/C=C/C2=CC(=C(S2)Br)Br

InChI

InChI=1S/C11H8Br2N2OS/c1-15-6-7(5-14-15)10(16)3-2-8-4-9(12)11(13)17-8/h2-6H,1H3/b3-2+