2-chloranyl-N4-(3-methylphenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: 2-chloranyl-N4-(3-methylphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: 2-chloro-N4-(m-tolyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: 2-chloro-N4-(3-methylphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 2-chloro-4-N-(3-methylphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: (6-amino-2-chloro-5-nitro-pyrimidin-4-yl)-(m-tolyl)amine Formula: C11H10ClN5O2 MolecularWeight: 279.6824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC(=NC(=C2[N+](=O)[O-])N)Cl

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC(=NC(=C2[N+](=O)[O-])N)Cl

InChI

InChI=1S/C11H10ClN5O2/c1-6-3-2-4-7(5-6)14-10-8(17(18)19)9(13)15-11(12)16-10/h2-5H,1H3,(H3,13,14,15,16)