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

Systemtic Name: methyl N-[3,5-bis(chloranyl)phenyl]-N'-cyclohexyl-carbamimidothioate Openeye Name: 3-cyclohexyl-1-(3,5-dichlorophenyl)-2-methyl-isothiourea CAS Name: N'-cyclohexyl-N-(3,5-dichlorophenyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N'-cyclohexyl-N-(3,5-dichlorophenyl)carbamimidothioate Traditional Name: 3-cyclohexyl-1-(3,5-dichlorophenyl)-2-methyl-isothiourea Formula: C14H18Cl2N2S MolecularWeight: 317.27712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC1CCCCC1)NC2=CC(=CC(=C2)Cl)Cl

Isomeric SMILES

CSC(=NC1CCCCC1)NC2=CC(=CC(=C2)Cl)Cl

InChI

InChI=1S/C14H18Cl2N2S/c1-19-14(17-12-5-3-2-4-6-12)18-13-8-10(15)7-11(16)9-13/h7-9,12H,2-6H2,1H3,(H,17,18)