3-[2-(2,4-dimethylphenoxy)butanoylamino]-N-(5-oxidanylidene-4-pyrazol-1-yl-1,4-dihydropyrazol-3-yl)benzamide

Systemtic Name: 3-[2-(2,4-dimethylphenoxy)butanoylamino]-N-(5-oxidanylidene-4-pyrazol-1-yl-1,4-dihydropyrazol-3-yl)benzamide Openeye Name: 3-[2-(2,4-dimethylphenoxy)butanoylamino]-N-(5-oxo-4-pyrazol-1-yl-1,4-dihydropyrazol-3-yl)benzamide CAS Name: 3-[[2-(2,4-dimethylphenoxy)-1-oxobutyl]amino]-N-[5-oxo-4-(1-pyrazolyl)-1,4-dihydropyrazol-3-yl]benzamide IUPAC Name: 3-[2-(2,4-dimethylphenoxy)butanoylamino]-N-(5-oxo-4-pyrazol-1-yl-1,4-dihydropyrazol-3-yl)benzamide Traditional Name: 3-[2-(2,4-dimethylphenoxy)butanoylamino]-N-(5-keto-4-pyrazol-1-yl-2-pyrazolin-3-yl)benzamide Formula: C25H26N6O4 MolecularWeight: 474.51174

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC(=C1)C(=O)NC2=NNC(=O)C2N3C=CC=N3)OC4=C(C=C(C=C4)C)C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC(=C1)C(=O)NC2=NNC(=O)C2N3C=CC=N3)OC4=C(C=C(C=C4)C)C

InChI

InChI=1S/C25H26N6O4/c1-4-19(35-20-10-9-15(2)13-16(20)3)24(33)27-18-8-5-7-17(14-18)23(32)28-22-21(25(34)30-29-22)31-12-6-11-26-31/h5-14,19,21H,4H2,1-3H3,(H,27,33)(H,30,34)(H,28,29,32)