N4-cyclopropyl-N2-[(4-ethoxyphenyl)methyl]-N2-methyl-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N4-cyclopropyl-N2-[(4-ethoxyphenyl)methyl]-N2-methyl-5-nitro-pyrimidine-2,4-diamine Openeye Name: N4-cyclopropyl-N2-[(4-ethoxyphenyl)methyl]-N2-methyl-5-nitro-pyrimidine-2,4-diamine CAS Name: N4-cyclopropyl-N2-[(4-ethoxyphenyl)methyl]-N2-methyl-5-nitropyrimidine-2,4-diamine IUPAC Name: 4-N-cyclopropyl-2-N-[(4-ethoxyphenyl)methyl]-2-N-methyl-5-nitropyrimidine-2,4-diamine Traditional Name: [4-(cyclopropylamino)-5-nitro-pyrimidin-2-yl]-(4-ethoxybenzyl)-methyl-amine Formula: C17H21N5O3 MolecularWeight: 343.38034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN(C)C2=NC=C(C(=N2)NC3CC3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)CN(C)C2=NC=C(C(=N2)NC3CC3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O3/c1-3-25-14-8-4-12(5-9-14)11-21(2)17-18-10-15(22(23)24)16(20-17)19-13-6-7-13/h4-5,8-10,13H,3,6-7,11H2,1-2H3,(H,18,19,20)