N-[4-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoylamino]phenyl]-3-methyl-butanamide

Systemtic Name: N-[4-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoylamino]phenyl]-3-methyl-butanamide Openeye Name: N-[4-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoylamino]phenyl]-3-methyl-butanamide CAS Name: N-[4-[[3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-1-oxopropyl]amino]phenyl]-3-methylbutanamide IUPAC Name: N-[4-[3-(3,5-dimethyl-1-phenylpyrazol-4-yl)propanoylamino]phenyl]-3-methylbutanamide Traditional Name: N-[4-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoylamino]phenyl]-3-methyl-butyramide Formula: C25H30N4O2 MolecularWeight: 418.5313

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)NC3=CC=C(C=C3)NC(=O)CC(C)C

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)NC3=CC=C(C=C3)NC(=O)CC(C)C

InChI

InChI=1S/C25H30N4O2/c1-17(2)16-25(31)27-21-12-10-20(11-13-21)26-24(30)15-14-23-18(3)28-29(19(23)4)22-8-6-5-7-9-22/h5-13,17H,14-16H2,1-4H3,(H,26,30)(H,27,31)