N2,N4-bis[(4-chlorophenyl)methyl]-5-nitro-pyrimidine-2,4,6-triamine

Systemtic Name: N2,N4-bis[(4-chlorophenyl)methyl]-5-nitro-pyrimidine-2,4,6-triamine Openeye Name: N2,N4-bis[(4-chlorophenyl)methyl]-5-nitro-pyrimidine-2,4,6-triamine CAS Name: N2,N4-bis[(4-chlorophenyl)methyl]-5-nitropyrimidine-2,4,6-triamine IUPAC Name: 2-N,4-N-bis[(4-chlorophenyl)methyl]-5-nitropyrimidine-2,4,6-triamine Traditional Name: [4-amino-6-[(4-chlorobenzyl)amino]-5-nitro-pyrimidin-2-yl]-(4-chlorobenzyl)amine Formula: C18H16Cl2N6O2 MolecularWeight: 419.26464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=NC(=NC(=C2[N+](=O)[O-])N)NCC3=CC=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1CNC2=NC(=NC(=C2[N+](=O)[O-])N)NCC3=CC=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H16Cl2N6O2/c19-13-5-1-11(2-6-13)9-22-17-15(26(27)28)16(21)24-18(25-17)23-10-12-3-7-14(20)8-4-12/h1-8H,9-10H2,(H4,21,22,23,24,25)