3-[4-(4-hydroxyphenyl)piperazin-1-yl]-1-(5-methyl-1-pyrimidin-2-yl-pyrazol-4-yl)propan-1-one

Systemtic Name: 3-[4-(4-hydroxyphenyl)piperazin-1-yl]-1-(5-methyl-1-pyrimidin-2-yl-pyrazol-4-yl)propan-1-one Openeye Name: 3-[4-(4-hydroxyphenyl)piperazin-1-yl]-1-(5-methyl-1-pyrimidin-2-yl-pyrazol-4-yl)propan-1-one CAS Name: 3-[4-(4-hydroxyphenyl)-1-piperazinyl]-1-[5-methyl-1-(2-pyrimidinyl)-4-pyrazolyl]-1-propanone IUPAC Name: 3-[4-(4-hydroxyphenyl)piperazin-1-yl]-1-(5-methyl-1-pyrimidin-2-ylpyrazol-4-yl)propan-1-one Traditional Name: 3-[4-(4-hydroxyphenyl)piperazino]-1-[5-methyl-1-(2-pyrimidyl)pyrazol-4-yl]propan-1-one Formula: C21H24N6O2 MolecularWeight: 392.45426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N6O2/c1-16-19(15-24-27(16)21-22-8-2-9-23-21)20(29)7-10-25-11-13-26(14-12-25)17-3-5-18(28)6-4-17/h2-6,8-9,15,28H,7,10-14H2,1H3