2-chloranyl-5-nitro-6-pentyl-N4-propan-2-yl-4H-pyrimidine-3,4-diamine

Systemtic Name: 2-chloranyl-5-nitro-6-pentyl-N4-propan-2-yl-4H-pyrimidine-3,4-diamine Openeye Name: 2-chloro-N4-isopropyl-5-nitro-6-pentyl-4H-pyrimidine-3,4-diamine CAS Name: 2-chloro-5-nitro-6-pentyl-N4-propan-2-yl-4H-pyrimidine-3,4-diamine IUPAC Name: 2-chloro-5-nitro-6-pentyl-4-N-propan-2-yl-4H-pyrimidine-3,4-diamine Traditional Name: (3-amino-6-amyl-2-chloro-5-nitro-4H-pyrimidin-4-yl)-isopropyl-amine Formula: C12H22ClN5O2 MolecularWeight: 303.78838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(N(C(=N1)Cl)N)NC(C)C)[N+](=O)[O-]

Isomeric SMILES

CCCCCC1=C(C(N(C(=N1)Cl)N)NC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C12H22ClN5O2/c1-4-5-6-7-9-10(18(19)20)11(15-8(2)3)17(14)12(13)16-9/h8,11,15H,4-7,14H2,1-3H3