N2-(4-ethoxyphenyl)-5-nitro-N4-(phenylmethyl)pyrimidine-2,4,6-triamine

Systemtic Name: N2-(4-ethoxyphenyl)-5-nitro-N4-(phenylmethyl)pyrimidine-2,4,6-triamine Openeye Name: N4-benzyl-N2-(4-ethoxyphenyl)-5-nitro-pyrimidine-2,4,6-triamine CAS Name: N2-(4-ethoxyphenyl)-5-nitro-N4-(phenylmethyl)pyrimidine-2,4,6-triamine IUPAC Name: 4-N-benzyl-2-N-(4-ethoxyphenyl)-5-nitropyrimidine-2,4,6-triamine Traditional Name: [4-amino-6-(benzylamino)-5-nitro-pyrimidin-2-yl]-p-phenetyl-amine Formula: C19H20N6O3 MolecularWeight: 380.4005

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC(=C(C(=N2)NCC3=CC=CC=C3)[N+](=O)[O-])N

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC(=C(C(=N2)NCC3=CC=CC=C3)[N+](=O)[O-])N

InChI

InChI=1S/C19H20N6O3/c1-2-28-15-10-8-14(9-11-15)22-19-23-17(20)16(25(26)27)18(24-19)21-12-13-6-4-3-5-7-13/h3-11H,2,12H2,1H3,(H4,20,21,22,23,24)