4-[2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propanoylamino]-1-ethyl-N-(2-methylpropyl)pyrazole-3-carboxamide

Systemtic Name: 4-[2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propanoylamino]-1-ethyl-N-(2-methylpropyl)pyrazole-3-carboxamide Openeye Name: 4-[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propanoylamino]-1-ethyl-N-isobutyl-pyrazole-3-carboxamide CAS Name: 4-[[2-(4-bromo-3,5-dimethyl-1-pyrazolyl)-1-oxopropyl]amino]-1-ethyl-N-(2-methylpropyl)-3-pyrazolecarboxamide IUPAC Name: 4-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-1-ethyl-N-(2-methylpropyl)pyrazole-3-carboxamide Traditional Name: 4-[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propanoylamino]-1-ethyl-N-isobutyl-pyrazole-3-carboxamide Formula: C18H27BrN6O2 MolecularWeight: 439.34998

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NCC(C)C)NC(=O)C(C)N2C(=C(C(=N2)C)Br)C

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NCC(C)C)NC(=O)C(C)N2C(=C(C(=N2)C)Br)C

InChI

InChI=1S/C18H27BrN6O2/c1-7-24-9-14(16(23-24)18(27)20-8-10(2)3)21-17(26)13(6)25-12(5)15(19)11(4)22-25/h9-10,13H,7-8H2,1-6H3,(H,20,27)(H,21,26)