4-[2-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)butanoylamino]-1-ethyl-N-phenyl-pyrazole-3-carboxamide

Systemtic Name: 4-[2-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)butanoylamino]-1-ethyl-N-phenyl-pyrazole-3-carboxamide Openeye Name: 4-[2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)butanoylamino]-1-ethyl-N-phenyl-pyrazole-3-carboxamide CAS Name: 4-[[2-(4-chloro-3,5-dimethyl-1-pyrazolyl)-1-oxobutyl]amino]-1-ethyl-N-phenyl-3-pyrazolecarboxamide IUPAC Name: 4-[2-(4-chloro-3,5-dimethylpyrazol-1-yl)butanoylamino]-1-ethyl-N-phenylpyrazole-3-carboxamide Traditional Name: 4-[2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)butanoylamino]-1-ethyl-N-phenyl-pyrazole-3-carboxamide Formula: C21H25ClN6O2 MolecularWeight: 428.9152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CN(N=C1C(=O)NC2=CC=CC=C2)CC)N3C(=C(C(=N3)C)Cl)C

Isomeric SMILES

CCC(C(=O)NC1=CN(N=C1C(=O)NC2=CC=CC=C2)CC)N3C(=C(C(=N3)C)Cl)C

InChI

InChI=1S/C21H25ClN6O2/c1-5-17(28-14(4)18(22)13(3)25-28)20(29)24-16-12-27(6-2)26-19(16)21(30)23-15-10-8-7-9-11-15/h7-12,17H,5-6H2,1-4H3,(H,23,30)(H,24,29)