1-[4-chloranyl-3-(trifluoromethyl)phenyl]-2-[4-[2-[di(propan-2-yl)amino]ethylamino]-6-methyl-pyrimidin-2-yl]guanidine

Systemtic Name: 1-[4-chloranyl-3-(trifluoromethyl)phenyl]-2-[4-[2-[di(propan-2-yl)amino]ethylamino]-6-methyl-pyrimidin-2-yl]guanidine Openeye Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-2-[4-[2-(diisopropylamino)ethylamino]-6-methyl-pyrimidin-2-yl]guanidine CAS Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-2-[4-[2-[di(propan-2-yl)amino]ethylamino]-6-methyl-2-pyrimidinyl]guanidine IUPAC Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-2-[4-[2-[di(propan-2-yl)amino]ethylamino]-6-methylpyrimidin-2-yl]guanidine Traditional Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-2-[4-[2-(diisopropylamino)ethylamino]-6-methyl-pyrimidin-2-yl]guanidine Formula: C21H29ClF3N7 MolecularWeight: 471.95007

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N=C(N)NC2=CC(=C(C=C2)Cl)C(F)(F)F)NCCN(C(C)C)C(C)C

Isomeric SMILES

CC1=CC(=NC(=N1)N=C(N)NC2=CC(=C(C=C2)Cl)C(F)(F)F)NCCN(C(C)C)C(C)C

InChI

InChI=1S/C21H29ClF3N7/c1-12(2)32(13(3)4)9-8-27-18-10-14(5)28-20(30-18)31-19(26)29-15-6-7-17(22)16(11-15)21(23,24)25/h6-7,10-13H,8-9H2,1-5H3,(H4,26,27,28,29,30,31)