(E)-3-(1,3-dimethylpyrazol-4-yl)-1-thiophen-2-yl-prop-2-en-1-one

Systemtic Name: (E)-3-(1,3-dimethylpyrazol-4-yl)-1-thiophen-2-yl-prop-2-en-1-one Openeye Name: (E)-3-(1,3-dimethylpyrazol-4-yl)-1-(2-thienyl)prop-2-en-1-one CAS Name: (E)-3-(1,3-dimethyl-4-pyrazolyl)-1-thiophen-2-yl-2-propen-1-one IUPAC Name: (E)-3-(1,3-dimethylpyrazol-4-yl)-1-thiophen-2-ylprop-2-en-1-one Traditional Name: (E)-3-(1,3-dimethylpyrazol-4-yl)-1-(2-thienyl)prop-2-en-1-one Formula: C12H12N2OS MolecularWeight: 232.30148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C=CC(=O)C2=CC=CS2)C

Isomeric SMILES

CC1=NN(C=C1/C=C/C(=O)C2=CC=CS2)C

InChI

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