(E)-3-[3-azanyl-6,6-di(pyrimidin-4-yl)-7H-indazol-1-yl]prop-2-enal

Systemtic Name: (E)-3-[3-azanyl-6,6-di(pyrimidin-4-yl)-7H-indazol-1-yl]prop-2-enal Openeye Name: (E)-3-[3-amino-6,6-di(pyrimidin-4-yl)-7H-indazol-1-yl]prop-2-enal CAS Name: (E)-3-[3-amino-6,6-bis(4-pyrimidinyl)-7H-indazol-1-yl]-2-propenal IUPAC Name: (E)-3-[3-amino-6,6-di(pyrimidin-4-yl)-7H-indazol-1-yl]prop-2-enal Traditional Name: (E)-3-[3-amino-6,6-bis(4-pyrimidyl)-7H-indazol-1-yl]acrolein Formula: C18H15N7O MolecularWeight: 345.358

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC1(C3=NC=NC=C3)C4=NC=NC=C4)C(=NN2C=CC=O)N

Isomeric SMILES

C1C2=C(C=CC1(C3=NC=NC=C3)C4=NC=NC=C4)C(=NN2/C=C/C=O)N

InChI

InChI=1S/C18H15N7O/c19-17-13-2-5-18(15-3-6-20-11-22-15,16-4-7-21-12-23-16)10-14(13)25(24-17)8-1-9-26/h1-9,11-12H,10H2,(H2,19,24)/b8-1+