2-[[2-[(4-chlorophenyl)amino]-5-nitro-pyrimidin-4-yl]amino]ethanamide

Systemtic Name: 2-[[2-[(4-chlorophenyl)amino]-5-nitro-pyrimidin-4-yl]amino]ethanamide Openeye Name: 2-[[2-(4-chloroanilino)-5-nitro-pyrimidin-4-yl]amino]acetamide CAS Name: 2-[[2-(4-chloroanilino)-5-nitro-4-pyrimidinyl]amino]acetamide IUPAC Name: 2-[[2-(4-chloroanilino)-5-nitropyrimidin-4-yl]amino]acetamide Traditional Name: 2-[[2-(4-chloroanilino)-5-nitro-pyrimidin-4-yl]amino]acetamide Formula: C12H11ClN6O3 MolecularWeight: 322.70714

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=NC=C(C(=N2)NCC(=O)N)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1NC2=NC=C(C(=N2)NCC(=O)N)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H11ClN6O3/c13-7-1-3-8(4-2-7)17-12-16-5-9(19(21)22)11(18-12)15-6-10(14)20/h1-5H,6H2,(H2,14,20)(H2,15,16,17,18)