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

Systemtic Name: methyl N-[3,5-bis(chloranyl)phenyl]-N'-cycloheptyl-carbamimidothioate Openeye Name: 3-cycloheptyl-1-(3,5-dichlorophenyl)-2-methyl-isothiourea CAS Name: N'-cycloheptyl-N-(3,5-dichlorophenyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N'-cycloheptyl-N-(3,5-dichlorophenyl)carbamimidothioate Traditional Name: 3-cycloheptyl-1-(3,5-dichlorophenyl)-2-methyl-isothiourea Formula: C15H20Cl2N2S MolecularWeight: 331.3037

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC1CCCCCC1)NC2=CC(=CC(=C2)Cl)Cl

Isomeric SMILES

CSC(=NC1CCCCCC1)NC2=CC(=CC(=C2)Cl)Cl

InChI

InChI=1S/C15H20Cl2N2S/c1-20-15(18-13-6-4-2-3-5-7-13)19-14-9-11(16)8-12(17)10-14/h8-10,13H,2-7H2,1H3,(H,18,19)