4-[2-(4-bromanylpyrazol-1-yl)butanoylamino]-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazole-3-carboxamide

Systemtic Name: 4-[2-(4-bromanylpyrazol-1-yl)butanoylamino]-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazole-3-carboxamide Openeye Name: 4-[2-(4-bromopyrazol-1-yl)butanoylamino]-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazole-3-carboxamide CAS Name: 4-[[2-(4-bromo-1-pyrazolyl)-1-oxobutyl]amino]-2-methyl-N-[(1-methyl-4-pyrazolyl)methyl]-3-pyrazolecarboxamide IUPAC Name: 4-[2-(4-bromopyrazol-1-yl)butanoylamino]-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazole-3-carboxamide Traditional Name: 4-[2-(4-bromopyrazol-1-yl)butanoylamino]-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazole-3-carboxamide Formula: C17H21BrN8O2 MolecularWeight: 449.30504

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(N(N=C1)C)C(=O)NCC2=CN(N=C2)C)N3C=C(C=N3)Br

Isomeric SMILES

CCC(C(=O)NC1=C(N(N=C1)C)C(=O)NCC2=CN(N=C2)C)N3C=C(C=N3)Br

InChI

InChI=1S/C17H21BrN8O2/c1-4-14(26-10-12(18)7-22-26)16(27)23-13-8-21-25(3)15(13)17(28)19-5-11-6-20-24(2)9-11/h6-10,14H,4-5H2,1-3H3,(H,19,28)(H,23,27)