5-[2-chloranyl-4-(trifluoromethyl)phenyl]-1-heptan-4-yl-6-methyl-imidazo[4,5-b]pyrazine

Systemtic Name: 5-[2-chloranyl-4-(trifluoromethyl)phenyl]-1-heptan-4-yl-6-methyl-imidazo[4,5-b]pyrazine Openeye Name: 5-[2-chloro-4-(trifluoromethyl)phenyl]-6-methyl-1-(1-propylbutyl)imidazo[4,5-b]pyrazine CAS Name: 5-[2-chloro-4-(trifluoromethyl)phenyl]-1-heptan-4-yl-6-methylimidazo[4,5-b]pyrazine IUPAC Name: 5-[2-chloro-4-(trifluoromethyl)phenyl]-1-heptan-4-yl-6-methylimidazo[4,5-b]pyrazine Traditional Name: 5-[2-chloro-4-(trifluoromethyl)phenyl]-6-methyl-1-(1-propylbutyl)imidazo[4,5-b]pyrazine Formula: C20H22ClF3N4 MolecularWeight: 410.86369

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)N1C=NC2=NC(=C(N=C21)C)C3=C(C=C(C=C3)C(F)(F)F)Cl

Isomeric SMILES

CCCC(CCC)N1C=NC2=NC(=C(N=C21)C)C3=C(C=C(C=C3)C(F)(F)F)Cl

InChI

InChI=1S/C20H22ClF3N4/c1-4-6-14(7-5-2)28-11-25-18-19(28)26-12(3)17(27-18)15-9-8-13(10-16(15)21)20(22,23)24/h8-11,14H,4-7H2,1-3H3