5-nitro-N2,N4-bis(phenylmethyl)pyrimidine-2,4-diamine

Systemtic Name: 5-nitro-N2,N4-bis(phenylmethyl)pyrimidine-2,4-diamine Openeye Name: N2,N4-dibenzyl-5-nitro-pyrimidine-2,4-diamine CAS Name: 5-nitro-N2,N4-bis(phenylmethyl)pyrimidine-2,4-diamine IUPAC Name: 2-N,4-N-dibenzyl-5-nitropyrimidine-2,4-diamine Traditional Name: benzyl-[2-(benzylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C18H17N5O2 MolecularWeight: 335.35988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC(=NC=C2[N+](=O)[O-])NCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC(=NC=C2[N+](=O)[O-])NCC3=CC=CC=C3

InChI

InChI=1S/C18H17N5O2/c24-23(25)16-13-21-18(20-12-15-9-5-2-6-10-15)22-17(16)19-11-14-7-3-1-4-8-14/h1-10,13H,11-12H2,(H2,19,20,21,22)