(E)-3-[1-(2-azanyl-6-chloranyl-pyrimidin-4-yl)-5-ethyl-pyrazol-4-yl]prop-2-enal

Systemtic Name: (E)-3-[1-(2-azanyl-6-chloranyl-pyrimidin-4-yl)-5-ethyl-pyrazol-4-yl]prop-2-enal Openeye Name: (E)-3-[1-(2-amino-6-chloro-pyrimidin-4-yl)-5-ethyl-pyrazol-4-yl]prop-2-enal CAS Name: (E)-3-[1-(2-amino-6-chloro-4-pyrimidinyl)-5-ethyl-4-pyrazolyl]-2-propenal IUPAC Name: (E)-3-[1-(2-amino-6-chloropyrimidin-4-yl)-5-ethylpyrazol-4-yl]prop-2-enal Traditional Name: (E)-3-[1-(2-amino-6-chloro-pyrimidin-4-yl)-5-ethyl-pyrazol-4-yl]acrolein Formula: C12H12ClN5O MolecularWeight: 277.70958

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=CC(=NC(=N2)N)Cl)C=CC=O

Isomeric SMILES

CCC1=C(C=NN1C2=CC(=NC(=N2)N)Cl)/C=C/C=O

InChI

InChI=1S/C12H12ClN5O/c1-2-9-8(4-3-5-19)7-15-18(9)11-6-10(13)16-12(14)17-11/h3-7H,2H2,1H3,(H2,14,16,17)/b4-3+