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

Systemtic Name: 2-chloranyl-6-morpholin-4-yl-5-nitro-N-[1-(phenylmethyl)piperidin-4-yl]pyrimidin-4-amine Openeye Name: N-(1-benzyl-4-piperidyl)-2-chloro-6-morpholino-5-nitro-pyrimidin-4-amine CAS Name: 2-chloro-6-(4-morpholinyl)-5-nitro-N-[1-(phenylmethyl)-4-piperidinyl]-4-pyrimidinamine IUPAC Name: N-(1-benzylpiperidin-4-yl)-2-chloro-6-morpholin-4-yl-5-nitropyrimidin-4-amine Traditional Name: (1-benzyl-4-piperidyl)-(2-chloro-6-morpholino-5-nitro-pyrimidin-4-yl)amine Formula: C20H25ClN6O3 MolecularWeight: 432.9039

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25ClN6O3/c21-20-23-18(17(27(28)29)19(24-20)26-10-12-30-13-11-26)22-16-6-8-25(9-7-16)14-15-4-2-1-3-5-15/h1-5,16H,6-14H2,(H,22,23,24)