(E)-1-(azetidin-1-yl)-3-[1-[(4-methylphenyl)methyl]-3-phenyl-pyrazol-4-yl]prop-2-en-1-one

Systemtic Name: (E)-1-(azetidin-1-yl)-3-[1-[(4-methylphenyl)methyl]-3-phenyl-pyrazol-4-yl]prop-2-en-1-one Openeye Name: (E)-1-(azetidin-1-yl)-3-[3-phenyl-1-(p-tolylmethyl)pyrazol-4-yl]prop-2-en-1-one CAS Name: (E)-1-(1-azetidinyl)-3-[1-[(4-methylphenyl)methyl]-3-phenyl-4-pyrazolyl]-2-propen-1-one IUPAC Name: (E)-1-(azetidin-1-yl)-3-[1-[(4-methylphenyl)methyl]-3-phenylpyrazol-4-yl]prop-2-en-1-one Traditional Name: (E)-1-(azetidin-1-yl)-3-[1-(4-methylbenzyl)-3-phenyl-pyrazol-4-yl]prop-2-en-1-one Formula: C23H23N3O MolecularWeight: 357.44822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CC=C3)C=CC(=O)N4CCC4

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CC=C3)/C=C/C(=O)N4CCC4

InChI

InChI=1S/C23H23N3O/c1-18-8-10-19(11-9-18)16-26-17-21(12-13-22(27)25-14-5-15-25)23(24-26)20-6-3-2-4-7-20/h2-4,6-13,17H,5,14-16H2,1H3/b13-12+