(4-methylsulfanylphenyl)methyl N'-(4-chlorophenyl)carbamimidothioate

Systemtic Name: (4-methylsulfanylphenyl)methyl N'-(4-chlorophenyl)carbamimidothioate Openeye Name: 3-(4-chlorophenyl)-2-[(4-methylsulfanylphenyl)methyl]isothiourea CAS Name: N'-(4-chlorophenyl)carbamimidothioic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl N'-(4-chlorophenyl)carbamimidothioate Traditional Name: 3-(4-chlorophenyl)-2-[4-(methylthio)benzyl]isothiourea Formula: C15H15ClN2S2 MolecularWeight: 322.876

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CSC(=NC2=CC=C(C=C2)Cl)N

Isomeric SMILES

CSC1=CC=C(C=C1)CSC(=NC2=CC=C(C=C2)Cl)N

InChI

InChI=1S/C15H15ClN2S2/c1-19-14-8-2-11(3-9-14)10-20-15(17)18-13-6-4-12(16)5-7-13/h2-9H,10H2,1H3,(H2,17,18)