(E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]prop-2-enamide

Systemtic Name: (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]prop-2-enamide Openeye Name: (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]prop-2-enamide CAS Name: (E)-3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-N-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl]-2-propenamide IUPAC Name: (E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]prop-2-enamide Traditional Name: (E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-[4-(pyrrolidine-1-carbonyl)benzyl]acrylamide Formula: C26H28N4O2 MolecularWeight: 428.52612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C=CC(=O)NCC3=CC=C(C=C3)C(=O)N4CCCC4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)/C=C/C(=O)NCC3=CC=C(C=C3)C(=O)N4CCCC4

InChI

InChI=1S/C26H28N4O2/c1-19-24(20(2)30(28-19)23-8-4-3-5-9-23)14-15-25(31)27-18-21-10-12-22(13-11-21)26(32)29-16-6-7-17-29/h3-5,8-15H,6-7,16-18H2,1-2H3,(H,27,31)/b15-14+