N6-(3,4-dichlorophenyl)-N4,N4-bis(2-methoxyethyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-(3,4-dichlorophenyl)-N4,N4-bis(2-methoxyethyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-(3,4-dichlorophenyl)-N4,N4-bis(2-methoxyethyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(3,4-dichlorophenyl)-N4,N4-bis(2-methoxyethyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-(3,4-dichlorophenyl)-4-N,4-N-bis(2-methoxyethyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(3,4-dichloroanilino)-5-nitro-pyrimidin-4-yl]-bis(2-methoxyethyl)amine Formula: C16H19Cl2N5O4 MolecularWeight: 416.25916

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CCOC)C1=NC=NC(=C1[N+](=O)[O-])NC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

COCCN(CCOC)C1=NC=NC(=C1[N+](=O)[O-])NC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H19Cl2N5O4/c1-26-7-5-22(6-8-27-2)16-14(23(24)25)15(19-10-20-16)21-11-3-4-12(17)13(18)9-11/h3-4,9-10H,5-8H2,1-2H3,(H,19,20,21)