4-[2-(4-bromanylpyrazol-1-yl)propanoylamino]-N-(furan-2-ylmethyl)-1-methyl-pyrazole-3-carboxamide

Systemtic Name: 4-[2-(4-bromanylpyrazol-1-yl)propanoylamino]-N-(furan-2-ylmethyl)-1-methyl-pyrazole-3-carboxamide Openeye Name: 4-[2-(4-bromopyrazol-1-yl)propanoylamino]-N-(2-furylmethyl)-1-methyl-pyrazole-3-carboxamide CAS Name: 4-[[2-(4-bromo-1-pyrazolyl)-1-oxopropyl]amino]-N-(2-furanylmethyl)-1-methyl-3-pyrazolecarboxamide IUPAC Name: 4-[2-(4-bromopyrazol-1-yl)propanoylamino]-N-(furan-2-ylmethyl)-1-methylpyrazole-3-carboxamide Traditional Name: 4-[2-(4-bromopyrazol-1-yl)propanoylamino]-N-(2-furfuryl)-1-methyl-pyrazole-3-carboxamide Formula: C16H17BrN6O3 MolecularWeight: 421.24858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CN(N=C1C(=O)NCC2=CC=CO2)C)N3C=C(C=N3)Br

Isomeric SMILES

CC(C(=O)NC1=CN(N=C1C(=O)NCC2=CC=CO2)C)N3C=C(C=N3)Br

InChI

InChI=1S/C16H17BrN6O3/c1-10(23-8-11(17)6-19-23)15(24)20-13-9-22(2)21-14(13)16(25)18-7-12-4-3-5-26-12/h3-6,8-10H,7H2,1-2H3,(H,18,25)(H,20,24)