4-bromanyl-N'-[3-(pyrimidin-2-ylamino)propanoyl]-1H-pyrrole-2-carbohydrazide

Systemtic Name: 4-bromanyl-N'-[3-(pyrimidin-2-ylamino)propanoyl]-1H-pyrrole-2-carbohydrazide Openeye Name: 4-bromo-N'-[3-(pyrimidin-2-ylamino)propanoyl]-1H-pyrrole-2-carbohydrazide CAS Name: 4-bromo-N'-[1-oxo-3-(2-pyrimidinylamino)propyl]-1H-pyrrole-2-carbohydrazide IUPAC Name: 4-bromo-N'-[3-(pyrimidin-2-ylamino)propanoyl]-1H-pyrrole-2-carbohydrazide Traditional Name: 4-bromo-N'-[3-(2-pyrimidylamino)propanoyl]-1H-pyrrole-2-carbohydrazide Formula: C12H13BrN6O2 MolecularWeight: 353.17462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NCCC(=O)NNC(=O)C2=CC(=CN2)Br

Isomeric SMILES

C1=CN=C(N=C1)NCCC(=O)NNC(=O)C2=CC(=CN2)Br

InChI

InChI=1S/C12H13BrN6O2/c13-8-6-9(17-7-8)11(21)19-18-10(20)2-5-16-12-14-3-1-4-15-12/h1,3-4,6-7,17H,2,5H2,(H,18,20)(H,19,21)(H,14,15,16)