(E)-3-[3-[2-azanyl-6-[(4-methoxyphenyl)methoxy]pyrimidin-4-yl]-5-methyl-1H-pyrazol-4-yl]prop-2-enal

Systemtic Name: (E)-3-[3-[2-azanyl-6-[(4-methoxyphenyl)methoxy]pyrimidin-4-yl]-5-methyl-1H-pyrazol-4-yl]prop-2-enal Openeye Name: (E)-3-[3-[2-amino-6-[(4-methoxyphenyl)methoxy]pyrimidin-4-yl]-5-methyl-1H-pyrazol-4-yl]prop-2-enal CAS Name: (E)-3-[3-[2-amino-6-[(4-methoxyphenyl)methoxy]-4-pyrimidinyl]-5-methyl-1H-pyrazol-4-yl]-2-propenal IUPAC Name: (E)-3-[3-[2-amino-6-[(4-methoxyphenyl)methoxy]pyrimidin-4-yl]-5-methyl-1H-pyrazol-4-yl]prop-2-enal Traditional Name: (E)-3-[3-(2-amino-6-p-anisyloxy-pyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl]acrolein Formula: C19H19N5O3 MolecularWeight: 365.38586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C2=CC(=NC(=N2)N)OCC3=CC=C(C=C3)OC)C=CC=O

Isomeric SMILES

CC1=C(C(=NN1)C2=CC(=NC(=N2)N)OCC3=CC=C(C=C3)OC)/C=C/C=O

InChI

InChI=1S/C19H19N5O3/c1-12-15(4-3-9-25)18(24-23-12)16-10-17(22-19(20)21-16)27-11-13-5-7-14(26-2)8-6-13/h3-10H,11H2,1-2H3,(H,23,24)(H2,20,21,22)/b4-3+