(E)-1-(2,5-dimethylthiophen-3-yl)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(2,5-dimethylthiophen-3-yl)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-1-(2,5-dimethyl-3-thienyl)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-1-(2,5-dimethyl-3-thiophenyl)-3-(1-phenyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-1-(2,5-dimethylthiophen-3-yl)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-1-(2,5-dimethyl-3-thienyl)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Formula: C18H16N2OS MolecularWeight: 308.39744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)C=CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)/C=C/C2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H16N2OS/c1-13-10-17(14(2)22-13)18(21)9-8-15-11-19-20(12-15)16-6-4-3-5-7-16/h3-12H,1-2H3/b9-8+