N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-4-oxidanylidene-4-(4-propylphenyl)butanamide

Systemtic Name: N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-4-oxidanylidene-4-(4-propylphenyl)butanamide Openeye Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-4-oxo-4-(4-propylphenyl)butanamide CAS Name: N-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methyl]-4-oxo-4-(4-propylphenyl)butanamide IUPAC Name: N-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]-4-oxo-4-(4-propylphenyl)butanamide Traditional Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-4-keto-4-(4-propylphenyl)butyramide Formula: C26H31N3O2 MolecularWeight: 417.54324

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)CCC(=O)NCC2=C(N(N=C2C)CC3=CC=CC=C3)C

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)CCC(=O)NCC2=C(N(N=C2C)CC3=CC=CC=C3)C

InChI

InChI=1S/C26H31N3O2/c1-4-8-21-11-13-23(14-12-21)25(30)15-16-26(31)27-17-24-19(2)28-29(20(24)3)18-22-9-6-5-7-10-22/h5-7,9-14H,4,8,15-18H2,1-3H3,(H,27,31)