(E)-3-[3-[4-(2-methylpropoxy)phenyl]-1-phenyl-pyrazol-4-yl]-1-thiophen-2-yl-prop-2-en-1-one

Systemtic Name: (E)-3-[3-[4-(2-methylpropoxy)phenyl]-1-phenyl-pyrazol-4-yl]-1-thiophen-2-yl-prop-2-en-1-one Openeye Name: (E)-3-[3-(4-isobutoxyphenyl)-1-phenyl-pyrazol-4-yl]-1-(2-thienyl)prop-2-en-1-one CAS Name: (E)-3-[3-[4-(2-methylpropoxy)phenyl]-1-phenyl-4-pyrazolyl]-1-thiophen-2-yl-2-propen-1-one IUPAC Name: (E)-3-[3-[4-(2-methylpropoxy)phenyl]-1-phenylpyrazol-4-yl]-1-thiophen-2-ylprop-2-en-1-one Traditional Name: (E)-3-[3-(4-isobutoxyphenyl)-1-phenyl-pyrazol-4-yl]-1-(2-thienyl)prop-2-en-1-one Formula: C26H24N2O2S MolecularWeight: 428.54596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C2=NN(C=C2C=CC(=O)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)C2=NN(C=C2/C=C/C(=O)C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C26H24N2O2S/c1-19(2)18-30-23-13-10-20(11-14-23)26-21(12-15-24(29)25-9-6-16-31-25)17-28(27-26)22-7-4-3-5-8-22/h3-17,19H,18H2,1-2H3/b15-12+