2-[2-chloranyl-5-methylsulfanyl-3-(trifluoromethyl)phenyl]-1-(3-ethylphenyl)-1-methyl-guanidine

Systemtic Name: 2-[2-chloranyl-5-methylsulfanyl-3-(trifluoromethyl)phenyl]-1-(3-ethylphenyl)-1-methyl-guanidine Openeye Name: 2-[2-chloro-5-methylsulfanyl-3-(trifluoromethyl)phenyl]-1-(3-ethylphenyl)-1-methyl-guanidine CAS Name: 2-[2-chloro-5-(methylthio)-3-(trifluoromethyl)phenyl]-1-(3-ethylphenyl)-1-methylguanidine IUPAC Name: 2-[2-chloro-5-methylsulfanyl-3-(trifluoromethyl)phenyl]-1-(3-ethylphenyl)-1-methylguanidine Traditional Name: 2-[2-chloro-5-(methylthio)-3-(trifluoromethyl)phenyl]-1-(3-ethylphenyl)-1-methyl-guanidine Formula: C18H19ClF3N3S MolecularWeight: 401.87677

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)N(C)C(=NC2=C(C(=CC(=C2)SC)C(F)(F)F)Cl)N

Isomeric SMILES

CCC1=CC(=CC=C1)N(C)C(=NC2=C(C(=CC(=C2)SC)C(F)(F)F)Cl)N

InChI

InChI=1S/C18H19ClF3N3S/c1-4-11-6-5-7-12(8-11)25(2)17(23)24-15-10-13(26-3)9-14(16(15)19)18(20,21)22/h5-10H,4H2,1-3H3,(H2,23,24)