N2,N4-bis(2-chloroethyl)-6-methyl-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N2,N4-bis(2-chloroethyl)-6-methyl-5-nitro-pyrimidine-2,4-diamine Openeye Name: N2,N4-bis(2-chloroethyl)-6-methyl-5-nitro-pyrimidine-2,4-diamine CAS Name: N2,N4-bis(2-chloroethyl)-6-methyl-5-nitropyrimidine-2,4-diamine IUPAC Name: 2-N,4-N-bis(2-chloroethyl)-6-methyl-5-nitropyrimidine-2,4-diamine Traditional Name: 2-chloroethyl-[2-(2-chloroethylamino)-6-methyl-5-nitro-pyrimidin-4-yl]amine Formula: C9H13Cl2N5O2 MolecularWeight: 294.13782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)NCCCl)NCCCl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=N1)NCCCl)NCCCl)[N+](=O)[O-]

InChI

InChI=1S/C9H13Cl2N5O2/c1-6-7(16(17)18)8(12-4-2-10)15-9(14-6)13-5-3-11/h2-5H2,1H3,(H2,12,13,14,15)