4-[4-[(E)-3-(5-methyl-1-pyrimidin-2-yl-pyrazol-4-yl)prop-2-enyl]piperazin-1-yl]phenol

Systemtic Name: 4-[4-[(E)-3-(5-methyl-1-pyrimidin-2-yl-pyrazol-4-yl)prop-2-enyl]piperazin-1-yl]phenol Openeye Name: 4-[4-[(E)-3-(5-methyl-1-pyrimidin-2-yl-pyrazol-4-yl)allyl]piperazin-1-yl]phenol CAS Name: 4-[4-[(E)-3-[5-methyl-1-(2-pyrimidinyl)-4-pyrazolyl]prop-2-enyl]-1-piperazinyl]phenol IUPAC Name: 4-[4-[(E)-3-(5-methyl-1-pyrimidin-2-ylpyrazol-4-yl)prop-2-enyl]piperazin-1-yl]phenol Traditional Name: 4-[4-[(E)-3-[5-methyl-1-(2-pyrimidyl)pyrazol-4-yl]allyl]piperazino]phenol Formula: C21H24N6O MolecularWeight: 376.45486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=NC=CC=N2)C=CCN3CCN(CC3)C4=CC=C(C=C4)O

Isomeric SMILES

CC1=C(C=NN1C2=NC=CC=N2)/C=C/CN3CCN(CC3)C4=CC=C(C=C4)O

InChI

InChI=1S/C21H24N6O/c1-17-18(16-24-27(17)21-22-9-3-10-23-21)4-2-11-25-12-14-26(15-13-25)19-5-7-20(28)8-6-19/h2-10,16,28H,11-15H2,1H3/b4-2+