5-nitro-N6-phenyl-N4,N4-bis(phenylmethyl)pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N6-phenyl-N4,N4-bis(phenylmethyl)pyrimidine-4,6-diamine Openeye Name: N4,N4-dibenzyl-5-nitro-N6-phenyl-pyrimidine-4,6-diamine CAS Name: 5-nitro-N6-phenyl-N4,N4-bis(phenylmethyl)pyrimidine-4,6-diamine IUPAC Name: 4-N,4-N-dibenzyl-5-nitro-6-N-phenylpyrimidine-4,6-diamine Traditional Name: (6-anilino-5-nitro-pyrimidin-4-yl)-dibenzyl-amine Formula: C24H21N5O2 MolecularWeight: 411.45584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=NC=NC(=C3[N+](=O)[O-])NC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=NC=NC(=C3[N+](=O)[O-])NC4=CC=CC=C4

InChI

InChI=1S/C24H21N5O2/c30-29(31)22-23(27-21-14-8-3-9-15-21)25-18-26-24(22)28(16-19-10-4-1-5-11-19)17-20-12-6-2-7-13-20/h1-15,18H,16-17H2,(H,25,26,27)