N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-[[(2S)-2-(4-methylphenoxy)-1-oxopropyl]amino]benzamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide Traditional Name: N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-3-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide Formula: C28H28N4O4 MolecularWeight: 484.54632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC(C)C(=O)NC2=CC=CC(=C2)C(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)O[C@@H](C)C(=O)NC2=CC=CC(=C2)C(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C

InChI

InChI=1S/C28H28N4O4/c1-18-13-15-24(16-14-18)36-20(3)26(33)29-22-10-8-9-21(17-22)27(34)30-25-19(2)31(4)32(28(25)35)23-11-6-5-7-12-23/h5-17,20H,1-4H3,(H,29,33)(H,30,34)/t20-/m0/s1