6-[(3S)-3-methylpiperidin-1-yl]-N2-(2-methylpropyl)-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: 6-[(3S)-3-methylpiperidin-1-yl]-N2-(2-methylpropyl)-5-nitro-pyrimidine-2,4-diamine Openeye Name: N2-isobutyl-6-[(3S)-3-methyl-1-piperidyl]-5-nitro-pyrimidine-2,4-diamine CAS Name: 6-[(3S)-3-methyl-1-piperidinyl]-N2-(2-methylpropyl)-5-nitropyrimidine-2,4-diamine IUPAC Name: 6-[(3S)-3-methylpiperidin-1-yl]-2-N-(2-methylpropyl)-5-nitropyrimidine-2,4-diamine Traditional Name: [4-amino-6-[(3S)-3-methylpiperidino]-5-nitro-pyrimidin-2-yl]-isobutyl-amine Formula: C14H24N6O2 MolecularWeight: 308.37936

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C(=NC(=N2)NCC(C)C)N)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCN(C1)C2=C(C(=NC(=N2)NCC(C)C)N)[N+](=O)[O-]

InChI

InChI=1S/C14H24N6O2/c1-9(2)7-16-14-17-12(15)11(20(21)22)13(18-14)19-6-4-5-10(3)8-19/h9-10H,4-8H2,1-3H3,(H3,15,16,17,18)/t10-/m0/s1