N4,N6-diethyl-N4,N6-bis(3-methylphenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4,N6-diethyl-N4,N6-bis(3-methylphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4,N6-diethyl-N4,N6-bis(m-tolyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4,N6-diethyl-N4,N6-bis(3-methylphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N,6-N-diethyl-4-N,6-N-bis(3-methylphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: ethyl-[6-(N-ethyl-3-methyl-anilino)-5-nitro-pyrimidin-4-yl]-(m-tolyl)amine Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1)C)C2=C(C(=NC=N2)N(CC)C3=CC=CC(=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCN(C1=CC=CC(=C1)C)C2=C(C(=NC=N2)N(CC)C3=CC=CC(=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C22H25N5O2/c1-5-25(18-11-7-9-16(3)13-18)21-20(27(28)29)22(24-15-23-21)26(6-2)19-12-8-10-17(4)14-19/h7-15H,5-6H2,1-4H3