methyl N-[3,5-bis(chloranyl)phenyl]-N-methyl-N'-(phenylmethyl)carbamimidothioate

Systemtic Name: methyl N-[3,5-bis(chloranyl)phenyl]-N-methyl-N'-(phenylmethyl)carbamimidothioate Openeye Name: 3-benzyl-1-(3,5-dichlorophenyl)-1,2-dimethyl-isothiourea CAS Name: N-(3,5-dichlorophenyl)-N-methyl-N'-(phenylmethyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N'-benzyl-N-(3,5-dichlorophenyl)-N-methylcarbamimidothioate Traditional Name: 3-benzyl-1-(3,5-dichlorophenyl)-1,2-dimethyl-isothiourea Formula: C16H16Cl2N2S MolecularWeight: 339.28264

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC(=CC(=C1)Cl)Cl)C(=NCC2=CC=CC=C2)SC

Isomeric SMILES

CN(C1=CC(=CC(=C1)Cl)Cl)C(=NCC2=CC=CC=C2)SC

InChI

InChI=1S/C16H16Cl2N2S/c1-20(15-9-13(17)8-14(18)10-15)16(21-2)19-11-12-6-4-3-5-7-12/h3-10H,11H2,1-2H3