1-azanyl-3-(4-chloranyl-6-methoxy-pyrimidin-2-yl)-2-[2-(trifluoromethyl)phenyl]sulfonyl-guanidine

Systemtic Name: 1-azanyl-3-(4-chloranyl-6-methoxy-pyrimidin-2-yl)-2-[2-(trifluoromethyl)phenyl]sulfonyl-guanidine Openeye Name: 1-amino-3-(4-chloro-6-methoxy-pyrimidin-2-yl)-2-[2-(trifluoromethyl)phenyl]sulfonyl-guanidine CAS Name: 1-amino-3-(4-chloro-6-methoxy-2-pyrimidinyl)-2-[2-(trifluoromethyl)phenyl]sulfonylguanidine IUPAC Name: 1-amino-3-(4-chloro-6-methoxypyrimidin-2-yl)-2-[2-(trifluoromethyl)phenyl]sulfonylguanidine Traditional Name: 1-amino-3-(4-chloro-6-methoxy-pyrimidin-2-yl)-2-[2-(trifluoromethyl)phenyl]sulfonyl-guanidine Formula: C13H12ClF3N6O3S MolecularWeight: 424.78599

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC(=NS(=O)(=O)C2=CC=CC=C2C(F)(F)F)NN)Cl

Isomeric SMILES

COC1=CC(=NC(=N1)N/C(=N\S(=O)(=O)C2=CC=CC=C2C(F)(F)F)/NN)Cl

InChI

InChI=1S/C13H12ClF3N6O3S/c1-26-10-6-9(14)19-11(20-10)21-12(22-18)23-27(24,25)8-5-3-2-4-7(8)13(15,16)17/h2-6H,18H2,1H3,(H2,19,20,21,22,23)