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

Systemtic Name: 4-[2-(4-bromanyl-3-methyl-pyrazol-1-yl)propanoylamino]-N-(furan-2-ylmethyl)-2-methyl-pyrazole-3-carboxamide Openeye Name: 4-[2-(4-bromo-3-methyl-pyrazol-1-yl)propanoylamino]-N-(2-furylmethyl)-2-methyl-pyrazole-3-carboxamide CAS Name: 4-[[2-(4-bromo-3-methyl-1-pyrazolyl)-1-oxopropyl]amino]-N-(2-furanylmethyl)-2-methyl-3-pyrazolecarboxamide IUPAC Name: 4-[2-(4-bromo-3-methylpyrazol-1-yl)propanoylamino]-N-(furan-2-ylmethyl)-2-methylpyrazole-3-carboxamide Traditional Name: 4-[2-(4-bromo-3-methyl-pyrazol-1-yl)propanoylamino]-N-(2-furfuryl)-2-methyl-pyrazole-3-carboxamide Formula: C17H19BrN6O3 MolecularWeight: 435.27516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1Br)C(C)C(=O)NC2=C(N(N=C2)C)C(=O)NCC3=CC=CO3

Isomeric SMILES

CC1=NN(C=C1Br)C(C)C(=O)NC2=C(N(N=C2)C)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C17H19BrN6O3/c1-10-13(18)9-24(22-10)11(2)16(25)21-14-8-20-23(3)15(14)17(26)19-7-12-5-4-6-27-12/h4-6,8-9,11H,7H2,1-3H3,(H,19,26)(H,21,25)