2-[4-[(E)-3-(4-cyclohexylpiperazin-1-yl)prop-1-enyl]-5-methyl-pyrazol-1-yl]pyrimidine

Systemtic Name: 2-[4-[(E)-3-(4-cyclohexylpiperazin-1-yl)prop-1-enyl]-5-methyl-pyrazol-1-yl]pyrimidine Openeye Name: 2-[4-[(E)-3-(4-cyclohexylpiperazin-1-yl)prop-1-enyl]-5-methyl-pyrazol-1-yl]pyrimidine CAS Name: 2-[4-[(E)-3-(4-cyclohexyl-1-piperazinyl)prop-1-enyl]-5-methyl-1-pyrazolyl]pyrimidine IUPAC Name: 2-[4-[(E)-3-(4-cyclohexylpiperazin-1-yl)prop-1-enyl]-5-methylpyrazol-1-yl]pyrimidine Traditional Name: 2-[4-[(E)-3-(4-cyclohexylpiperazino)prop-1-enyl]-5-methyl-pyrazol-1-yl]pyrimidine Formula: C21H30N6 MolecularWeight: 366.5031

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=NC=CC=N2)C=CCN3CCN(CC3)C4CCCCC4

Isomeric SMILES

CC1=C(C=NN1C2=NC=CC=N2)/C=C/CN3CCN(CC3)C4CCCCC4

InChI

InChI=1S/C21H30N6/c1-18-19(17-24-27(18)21-22-10-6-11-23-21)7-5-12-25-13-15-26(16-14-25)20-8-3-2-4-9-20/h5-7,10-11,17,20H,2-4,8-9,12-16H2,1H3/b7-5+