N,N-bis(2-methylpropyl)-5-nitro-6-[4-(phenylmethyl)piperidin-1-yl]pyrimidin-4-amine

Systemtic Name: N,N-bis(2-methylpropyl)-5-nitro-6-[4-(phenylmethyl)piperidin-1-yl]pyrimidin-4-amine Openeye Name: 6-(4-benzyl-1-piperidyl)-N,N-diisobutyl-5-nitro-pyrimidin-4-amine CAS Name: N,N-bis(2-methylpropyl)-5-nitro-6-[4-(phenylmethyl)-1-piperidinyl]-4-pyrimidinamine IUPAC Name: 6-(4-benzylpiperidin-1-yl)-N,N-bis(2-methylpropyl)-5-nitropyrimidin-4-amine Traditional Name: [6-(4-benzylpiperidino)-5-nitro-pyrimidin-4-yl]-diisobutyl-amine Formula: C24H35N5O2 MolecularWeight: 425.567

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C1=NC=NC(=C1[N+](=O)[O-])N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)CN(CC(C)C)C1=NC=NC(=C1[N+](=O)[O-])N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C24H35N5O2/c1-18(2)15-28(16-19(3)4)24-22(29(30)31)23(25-17-26-24)27-12-10-21(11-13-27)14-20-8-6-5-7-9-20/h5-9,17-19,21H,10-16H2,1-4H3