(E)-1-(3,5-dimethylpyrazol-1-yl)-3-thiophen-2-yl-prop-2-en-1-one

Systemtic Name: (E)-1-(3,5-dimethylpyrazol-1-yl)-3-thiophen-2-yl-prop-2-en-1-one Openeye Name: (E)-1-(3,5-dimethylpyrazol-1-yl)-3-(2-thienyl)prop-2-en-1-one CAS Name: (E)-1-(3,5-dimethyl-1-pyrazolyl)-3-thiophen-2-yl-2-propen-1-one IUPAC Name: (E)-1-(3,5-dimethylpyrazol-1-yl)-3-thiophen-2-ylprop-2-en-1-one Traditional Name: (E)-1-(3,5-dimethylpyrazol-1-yl)-3-(2-thienyl)prop-2-en-1-one Formula: C12H12N2OS MolecularWeight: 232.30148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)C=CC2=CC=CS2)C

Isomeric SMILES

CC1=CC(=NN1C(=O)/C=C/C2=CC=CS2)C

InChI

InChI=1S/C12H12N2OS/c1-9-8-10(2)14(13-9)12(15)6-5-11-4-3-7-16-11/h3-8H,1-2H3/b6-5+