2-[ethyl-[5-nitro-6-[4-(phenylmethyl)piperazin-1-yl]pyrimidin-4-yl]amino]ethanol

Systemtic Name: 2-[ethyl-[5-nitro-6-[4-(phenylmethyl)piperazin-1-yl]pyrimidin-4-yl]amino]ethanol Openeye Name: 2-[[6-(4-benzylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]-ethyl-amino]ethanol CAS Name: 2-[ethyl-[5-nitro-6-[4-(phenylmethyl)-1-piperazinyl]-4-pyrimidinyl]amino]ethanol IUPAC Name: 2-[[6-(4-benzylpiperazin-1-yl)-5-nitropyrimidin-4-yl]-ethylamino]ethanol Traditional Name: 2-[[6-(4-benzylpiperazino)-5-nitro-pyrimidin-4-yl]-ethyl-amino]ethanol Formula: C19H26N6O3 MolecularWeight: 386.44814

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCO)C1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCN(CCO)C1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C19H26N6O3/c1-2-23(12-13-26)18-17(25(27)28)19(21-15-20-18)24-10-8-22(9-11-24)14-16-6-4-3-5-7-16/h3-7,15,26H,2,8-14H2,1H3