1-tert-butyl-2-[5-nitro-6-[4-(phenylmethyl)piperidin-1-yl]pyrimidin-4-yl]diazane

Systemtic Name: 1-tert-butyl-2-[5-nitro-6-[4-(phenylmethyl)piperidin-1-yl]pyrimidin-4-yl]diazane Openeye Name: 1-[6-(4-benzyl-1-piperidyl)-5-nitro-pyrimidin-4-yl]-2-tert-butyl-hydrazine CAS Name: 1-tert-butyl-2-[5-nitro-6-[4-(phenylmethyl)-1-piperidinyl]-4-pyrimidinyl]hydrazine IUPAC Name: 1-[6-(4-benzylpiperidin-1-yl)-5-nitropyrimidin-4-yl]-2-tert-butylhydrazine Traditional Name: 1-[6-(4-benzylpiperidino)-5-nitro-pyrimidin-4-yl]-2-tert-butyl-hydrazine Formula: C20H28N6O2 MolecularWeight: 384.47532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NNC1=NC=NC(=C1[N+](=O)[O-])N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NNC1=NC=NC(=C1[N+](=O)[O-])N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H28N6O2/c1-20(2,3)24-23-18-17(26(27)28)19(22-14-21-18)25-11-9-16(10-12-25)13-15-7-5-4-6-8-15/h4-8,14,16,24H,9-13H2,1-3H3,(H,21,22,23)