(E)-1-(4-tert-butylphenyl)-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-tert-butylphenyl)-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-1-(4-tert-butylphenyl)-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]prop-2-en-1-one CAS Name: (E)-1-(4-tert-butylphenyl)-3-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]-2-propen-1-one IUPAC Name: (E)-1-(4-tert-butylphenyl)-3-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-1-(4-tert-butylphenyl)-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]prop-2-en-1-one Formula: C27H25N3O MolecularWeight: 407.5069

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)C=CC2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)/C=C/C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H25N3O/c1-27(2,3)23-14-11-20(12-15-23)25(31)16-13-22-19-30(24-9-5-4-6-10-24)29-26(22)21-8-7-17-28-18-21/h4-19H,1-3H3/b16-13+