2-[4-[(E)-1-(4-methylpiperazin-1-yl)-4-phenyl-but-3-en-2-yl]piperazin-1-yl]-N-oxidanyl-pyrimidine-5-carboxamide

Systemtic Name: 2-[4-[(E)-1-(4-methylpiperazin-1-yl)-4-phenyl-but-3-en-2-yl]piperazin-1-yl]-N-oxidanyl-pyrimidine-5-carboxamide Openeye Name: 2-[4-[(E)-1-[(4-methylpiperazin-1-yl)methyl]-3-phenyl-allyl]piperazin-1-yl]pyrimidine-5-carbohydroxamic acid CAS Name: N-hydroxy-2-[4-[(E)-1-(4-methyl-1-piperazinyl)-4-phenylbut-3-en-2-yl]-1-piperazinyl]-5-pyrimidinecarboxamide IUPAC Name: N-hydroxy-2-[4-[(E)-1-(4-methylpiperazin-1-yl)-4-phenylbut-3-en-2-yl]piperazin-1-yl]pyrimidine-5-carboxamide Traditional Name: 2-[4-[(E)-1-[(4-methylpiperazino)methyl]-3-phenyl-allyl]piperazino]pyrimidine-5-carbohydroxamic acid Formula: C24H33N7O2 MolecularWeight: 451.56452

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC(C=CC2=CC=CC=C2)N3CCN(CC3)C4=NC=C(C=N4)C(=O)NO

Isomeric SMILES

CN1CCN(CC1)CC(/C=C/C2=CC=CC=C2)N3CCN(CC3)C4=NC=C(C=N4)C(=O)NO

InChI

InChI=1S/C24H33N7O2/c1-28-9-11-29(12-10-28)19-22(8-7-20-5-3-2-4-6-20)30-13-15-31(16-14-30)24-25-17-21(18-26-24)23(32)27-33/h2-8,17-18,22,33H,9-16,19H2,1H3,(H,27,32)/b8-7+