1-[2-[(4-chlorophenyl)amino]-5-nitro-pyrimidin-4-yl]-1-methyl-guanidine

Systemtic Name: 1-[2-[(4-chlorophenyl)amino]-5-nitro-pyrimidin-4-yl]-1-methyl-guanidine Openeye Name: 1-[2-(4-chloroanilino)-5-nitro-pyrimidin-4-yl]-1-methyl-guanidine CAS Name: 1-[2-(4-chloroanilino)-5-nitro-4-pyrimidinyl]-1-methylguanidine IUPAC Name: 1-[2-(4-chloroanilino)-5-nitropyrimidin-4-yl]-1-methylguanidine Traditional Name: 1-[2-(4-chloroanilino)-5-nitro-pyrimidin-4-yl]-1-methyl-guanidine Formula: C12H12ClN7O2 MolecularWeight: 321.72238

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=NC(=NC=C1[N+](=O)[O-])NC2=CC=C(C=C2)Cl)C(=N)N

Isomeric SMILES

CN(C1=NC(=NC=C1[N+](=O)[O-])NC2=CC=C(C=C2)Cl)C(=N)N

InChI

InChI=1S/C12H12ClN7O2/c1-19(11(14)15)10-9(20(21)22)6-16-12(18-10)17-8-4-2-7(13)3-5-8/h2-6H,1H3,(H3,14,15)(H,16,17,18)