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

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-[4-(3-methylphenoxy)butanoylamino]benzamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-[4-(3-methylphenoxy)butanoylamino]benzamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-[[4-(3-methylphenoxy)-1-oxobutyl]amino]benzamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-[4-(3-methylphenoxy)butanoylamino]benzamide Traditional Name: N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-3-[4-(3-methylphenoxy)butanoylamino]benzamide Formula: C29H30N4O4 MolecularWeight: 498.5729

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H30N4O4/c1-20-10-7-15-25(18-20)37-17-9-16-26(34)30-23-12-8-11-22(19-23)28(35)31-27-21(2)32(3)33(29(27)36)24-13-5-4-6-14-24/h4-8,10-15,18-19H,9,16-17H2,1-3H3,(H,30,34)(H,31,35)