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

Systemtic Name: 2-(2-chloranyl-5-methylsulfanyl-phenyl)-1-methyl-1-[3-(phenylmethylsulfanyl)phenyl]guanidine Openeye Name: 1-(3-benzylsulfanylphenyl)-2-(2-chloro-5-methylsulfanyl-phenyl)-1-methyl-guanidine CAS Name: 2-[2-chloro-5-(methylthio)phenyl]-1-methyl-1-[3-(phenylmethylthio)phenyl]guanidine IUPAC Name: 1-(3-benzylsulfanylphenyl)-2-(2-chloro-5-methylsulfanylphenyl)-1-methylguanidine Traditional Name: 1-[3-(benzylthio)phenyl]-2-[2-chloro-5-(methylthio)phenyl]-1-methyl-guanidine Formula: C22H22ClN3S2 MolecularWeight: 428.01318

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC(=CC=C1)SCC2=CC=CC=C2)C(=NC3=C(C=CC(=C3)SC)Cl)N

Isomeric SMILES

CN(C1=CC(=CC=C1)SCC2=CC=CC=C2)C(=NC3=C(C=CC(=C3)SC)Cl)N

InChI

InChI=1S/C22H22ClN3S2/c1-26(22(24)25-21-14-18(27-2)11-12-20(21)23)17-9-6-10-19(13-17)28-15-16-7-4-3-5-8-16/h3-14H,15H2,1-2H3,(H2,24,25)