N6-(3-methylphenyl)-5-nitro-N4-propan-2-yl-pyrimidine-4,6-diamine

Systemtic Name: N6-(3-methylphenyl)-5-nitro-N4-propan-2-yl-pyrimidine-4,6-diamine Openeye Name: N4-isopropyl-N6-(m-tolyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(3-methylphenyl)-5-nitro-N4-propan-2-ylpyrimidine-4,6-diamine IUPAC Name: 6-N-(3-methylphenyl)-5-nitro-4-N-propan-2-ylpyrimidine-4,6-diamine Traditional Name: isopropyl-[6-(m-toluidino)-5-nitro-pyrimidin-4-yl]amine Formula: C14H17N5O2 MolecularWeight: 287.31708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=C(C(=NC=N2)NC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)NC2=C(C(=NC=N2)NC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C14H17N5O2/c1-9(2)17-13-12(19(20)21)14(16-8-15-13)18-11-6-4-5-10(3)7-11/h4-9H,1-3H3,(H2,15,16,17,18)