6-morpholin-4-yl-5-nitro-N-[1-(phenylmethyl)piperidin-4-yl]pyrimidin-4-amine

Systemtic Name: 6-morpholin-4-yl-5-nitro-N-[1-(phenylmethyl)piperidin-4-yl]pyrimidin-4-amine Openeye Name: N-(1-benzyl-4-piperidyl)-6-morpholino-5-nitro-pyrimidin-4-amine CAS Name: 6-(4-morpholinyl)-5-nitro-N-[1-(phenylmethyl)-4-piperidinyl]-4-pyrimidinamine IUPAC Name: N-(1-benzylpiperidin-4-yl)-6-morpholin-4-yl-5-nitropyrimidin-4-amine Traditional Name: (1-benzyl-4-piperidyl)-(6-morpholino-5-nitro-pyrimidin-4-yl)amine Formula: C20H26N6O3 MolecularWeight: 398.45884

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=NC=NC(=C2[N+](=O)[O-])N3CCOCC3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1NC2=NC=NC(=C2[N+](=O)[O-])N3CCOCC3)CC4=CC=CC=C4

InChI

InChI=1S/C20H26N6O3/c27-26(28)18-19(21-15-22-20(18)25-10-12-29-13-11-25)23-17-6-8-24(9-7-17)14-16-4-2-1-3-5-16/h1-5,15,17H,6-14H2,(H,21,22,23)