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

Systemtic Name: 6-ethyl-5-nitro-N2,N4-bis(phenylmethyl)pyrimidine-2,4-diamine Openeye Name: N2,N4-dibenzyl-6-ethyl-5-nitro-pyrimidine-2,4-diamine CAS Name: 6-ethyl-5-nitro-N2,N4-bis(phenylmethyl)pyrimidine-2,4-diamine IUPAC Name: 2-N,4-N-dibenzyl-6-ethyl-5-nitropyrimidine-2,4-diamine Traditional Name: benzyl-[2-(benzylamino)-6-ethyl-5-nitro-pyrimidin-4-yl]amine Formula: C20H21N5O2 MolecularWeight: 363.41304

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)NCC2=CC=CC=C2)NCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C(=NC(=N1)NCC2=CC=CC=C2)NCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O2/c1-2-17-18(25(26)27)19(21-13-15-9-5-3-6-10-15)24-20(23-17)22-14-16-11-7-4-8-12-16/h3-12H,2,13-14H2,1H3,(H2,21,22,23,24)