4-[6-methyl-5-nitro-2-[4-(phenylmethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine

Systemtic Name: 4-[6-methyl-5-nitro-2-[4-(phenylmethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine Openeye Name: 4-[2-(4-benzylpiperazin-1-yl)-6-methyl-5-nitro-pyrimidin-4-yl]morpholine CAS Name: 4-[6-methyl-5-nitro-2-[4-(phenylmethyl)-1-piperazinyl]-4-pyrimidinyl]morpholine IUPAC Name: 4-[2-(4-benzylpiperazin-1-yl)-6-methyl-5-nitropyrimidin-4-yl]morpholine Traditional Name: 4-[2-(4-benzylpiperazino)-6-methyl-5-nitro-pyrimidin-4-yl]morpholine Formula: C20H26N6O3 MolecularWeight: 398.45884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)N2CCN(CC2)CC3=CC=CC=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=N1)N2CCN(CC2)CC3=CC=CC=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C20H26N6O3/c1-16-18(26(27)28)19(24-11-13-29-14-12-24)22-20(21-16)25-9-7-23(8-10-25)15-17-5-3-2-4-6-17/h2-6H,7-15H2,1H3