6-morpholin-4-yl-5-nitro-2-[4-(phenylmethyl)piperidin-1-yl]pyrimidin-4-amine

Systemtic Name: 6-morpholin-4-yl-5-nitro-2-[4-(phenylmethyl)piperidin-1-yl]pyrimidin-4-amine Openeye Name: 2-(4-benzyl-1-piperidyl)-6-morpholino-5-nitro-pyrimidin-4-amine CAS Name: 6-(4-morpholinyl)-5-nitro-2-[4-(phenylmethyl)-1-piperidinyl]-4-pyrimidinamine IUPAC Name: 2-(4-benzylpiperidin-1-yl)-6-morpholin-4-yl-5-nitropyrimidin-4-amine Traditional Name: [2-(4-benzylpiperidino)-6-morpholino-5-nitro-pyrimidin-4-yl]amine Formula: C20H26N6O3 MolecularWeight: 398.45884

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=NC(=C(C(=N3)N)[N+](=O)[O-])N4CCOCC4

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=NC(=C(C(=N3)N)[N+](=O)[O-])N4CCOCC4

InChI

InChI=1S/C20H26N6O3/c21-18-17(26(27)28)19(24-10-12-29-13-11-24)23-20(22-18)25-8-6-16(7-9-25)14-15-4-2-1-3-5-15/h1-5,16H,6-14H2,(H2,21,22,23)