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

Systemtic Name: 6-[4-(diphenylmethyl)piperazin-1-yl]-N,N-bis(2-methylpropyl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-(4-benzhydrylpiperazin-1-yl)-N,N-diisobutyl-5-nitro-pyrimidin-4-amine CAS Name: 6-[4-(diphenylmethyl)-1-piperazinyl]-N,N-bis(2-methylpropyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-(4-benzhydrylpiperazin-1-yl)-N,N-bis(2-methylpropyl)-5-nitropyrimidin-4-amine Traditional Name: [6-(4-benzhydrylpiperazino)-5-nitro-pyrimidin-4-yl]-diisobutyl-amine Formula: C29H38N6O2 MolecularWeight: 502.65102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)CN(CC(C)C)C1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H38N6O2/c1-22(2)19-34(20-23(3)4)29-27(35(36)37)28(30-21-31-29)33-17-15-32(16-18-33)26(24-11-7-5-8-12-24)25-13-9-6-10-14-25/h5-14,21-23,26H,15-20H2,1-4H3