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

Systemtic Name: 2-[4,6-bis(trifluoromethyl)pyrimidin-2-yl]-1-(3-methylphenyl)guanidine Openeye Name: 2-[4,6-bis(trifluoromethyl)pyrimidin-2-yl]-1-(m-tolyl)guanidine CAS Name: 2-[4,6-bis(trifluoromethyl)-2-pyrimidinyl]-1-(3-methylphenyl)guanidine IUPAC Name: 2-[4,6-bis(trifluoromethyl)pyrimidin-2-yl]-1-(3-methylphenyl)guanidine Traditional Name: 2-[4,6-bis(trifluoromethyl)pyrimidin-2-yl]-1-(m-tolyl)guanidine Formula: C14H11F6N5 MolecularWeight: 363.261059

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=NC2=NC(=CC(=N2)C(F)(F)F)C(F)(F)F)N

Isomeric SMILES

CC1=CC(=CC=C1)N/C(=N/C2=NC(=CC(=N2)C(F)(F)F)C(F)(F)F)/N

InChI

InChI=1S/C14H11F6N5/c1-7-3-2-4-8(5-7)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)