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

Systemtic Name: N2,N4-bis(4-ethylphenyl)-6-methyl-5-nitro-pyrimidine-2,4-diamine Openeye Name: N2,N4-bis(4-ethylphenyl)-6-methyl-5-nitro-pyrimidine-2,4-diamine CAS Name: N2,N4-bis(4-ethylphenyl)-6-methyl-5-nitropyrimidine-2,4-diamine IUPAC Name: 2-N,4-N-bis(4-ethylphenyl)-6-methyl-5-nitropyrimidine-2,4-diamine Traditional Name: [2-(4-ethylanilino)-6-methyl-5-nitro-pyrimidin-4-yl]-(4-ethylphenyl)amine Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=NC(=NC(=C2[N+](=O)[O-])C)NC3=CC=C(C=C3)CC

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=NC(=NC(=C2[N+](=O)[O-])C)NC3=CC=C(C=C3)CC

InChI

InChI=1S/C21H23N5O2/c1-4-15-6-10-17(11-7-15)23-20-19(26(27)28)14(3)22-21(25-20)24-18-12-8-16(5-2)9-13-18/h6-13H,4-5H2,1-3H3,(H2,22,23,24,25)