N4-(3-methoxyphenyl)-5-nitro-N6-(phenylmethyl)pyrimidine-4,6-diamine

Systemtic Name: N4-(3-methoxyphenyl)-5-nitro-N6-(phenylmethyl)pyrimidine-4,6-diamine Openeye Name: N6-benzyl-N4-(3-methoxyphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(3-methoxyphenyl)-5-nitro-N6-(phenylmethyl)pyrimidine-4,6-diamine IUPAC Name: 6-N-benzyl-4-N-(3-methoxyphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: benzyl-[6-(m-anisidino)-5-nitro-pyrimidin-4-yl]amine Formula: C18H17N5O3 MolecularWeight: 351.35928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=C(C(=NC=N2)NCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)NC2=C(C(=NC=N2)NCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O3/c1-26-15-9-5-8-14(10-15)22-18-16(23(24)25)17(20-12-21-18)19-11-13-6-3-2-4-7-13/h2-10,12H,11H2,1H3,(H2,19,20,21,22)