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

Systemtic Name: 4-[2-(4-bromanyl-3-methyl-pyrazol-1-yl)propanoylamino]-1-ethyl-N-propyl-pyrazole-3-carboxamide Openeye Name: 4-[2-(4-bromo-3-methyl-pyrazol-1-yl)propanoylamino]-1-ethyl-N-propyl-pyrazole-3-carboxamide CAS Name: 4-[[2-(4-bromo-3-methyl-1-pyrazolyl)-1-oxopropyl]amino]-1-ethyl-N-propyl-3-pyrazolecarboxamide IUPAC Name: 4-[2-(4-bromo-3-methylpyrazol-1-yl)propanoylamino]-1-ethyl-N-propylpyrazole-3-carboxamide Traditional Name: 4-[2-(4-bromo-3-methyl-pyrazol-1-yl)propanoylamino]-1-ethyl-N-propyl-pyrazole-3-carboxamide Formula: C16H23BrN6O2 MolecularWeight: 411.29682

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=NN(C=C1NC(=O)C(C)N2C=C(C(=N2)C)Br)CC

Isomeric SMILES

CCCNC(=O)C1=NN(C=C1NC(=O)C(C)N2C=C(C(=N2)C)Br)CC

InChI

InChI=1S/C16H23BrN6O2/c1-5-7-18-16(25)14-13(9-22(6-2)21-14)19-15(24)11(4)23-8-12(17)10(3)20-23/h8-9,11H,5-7H2,1-4H3,(H,18,25)(H,19,24)