2-[4,6-bis(trifluoromethyl)pyrimidin-2-yl]-1-(3-methoxyphenyl)guanidine

Systemtic Name: 2-[4,6-bis(trifluoromethyl)pyrimidin-2-yl]-1-(3-methoxyphenyl)guanidine Openeye Name: 2-[4,6-bis(trifluoromethyl)pyrimidin-2-yl]-1-(3-methoxyphenyl)guanidine CAS Name: 2-[4,6-bis(trifluoromethyl)-2-pyrimidinyl]-1-(3-methoxyphenyl)guanidine IUPAC Name: 2-[4,6-bis(trifluoromethyl)pyrimidin-2-yl]-1-(3-methoxyphenyl)guanidine Traditional Name: 2-[4,6-bis(trifluoromethyl)pyrimidin-2-yl]-1-(3-methoxyphenyl)guanidine Formula: C14H11F6N5O MolecularWeight: 379.260459

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=NC2=NC(=CC(=N2)C(F)(F)F)C(F)(F)F)N

Isomeric SMILES

COC1=CC=CC(=C1)N/C(=N/C2=NC(=CC(=N2)C(F)(F)F)C(F)(F)F)/N

InChI

InChI=1S/C14H11F6N5O/c1-26-8-4-2-3-7(5-8)22-11(21)25-12-23-9(13(15,16)17)6-10(24-12)14(18,19)20/h2-6H,1H3,(H3,21,22,23,24,25)