2-(2-chloranyl-3-ethyl-5-methylsulfanyl-phenyl)-1-(3-ethylphenyl)-1-methyl-guanidine hydrochloride

Systemtic Name: 2-(2-chloranyl-3-ethyl-5-methylsulfanyl-phenyl)-1-(3-ethylphenyl)-1-methyl-guanidine hydrochloride Openeye Name: 2-(2-chloro-3-ethyl-5-methylsulfanyl-phenyl)-1-(3-ethylphenyl)-1-methyl-guanidine hydrochloride CAS Name: 2-[2-chloro-3-ethyl-5-(methylthio)phenyl]-1-(3-ethylphenyl)-1-methylguanidine hydrochloride IUPAC Name: 2-(2-chloro-3-ethyl-5-methylsulfanylphenyl)-1-(3-ethylphenyl)-1-methylguanidine hydrochloride Traditional Name: 2-[2-chloro-3-ethyl-5-(methylthio)phenyl]-1-(3-ethylphenyl)-1-methyl-guanidine hydrochloride Formula: C19H25Cl2N3S MolecularWeight: 398.3929

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24ClN3S.ClH/c1-5-13-8-7-9-15(10-13)23(3)19(21)22-17-12-16(24-4)11-14(6-2)18(17)20;/h7-12H,5-6H2,1-4H3,(H2,21,22);1H