methyl N'-cyclohexyl-N-(phenylsulfonyl)carbamimidothioate

Systemtic Name: methyl N'-cyclohexyl-N-(phenylsulfonyl)carbamimidothioate Openeye Name: 1-(benzenesulfonyl)-3-cyclohexyl-2-methyl-isothiourea CAS Name: N-(benzenesulfonyl)-N'-cyclohexylcarbamimidothioic acid methyl ester IUPAC Name: methyl N-(benzenesulfonyl)-N'-cyclohexylcarbamimidothioate Traditional Name: 1-besyl-3-cyclohexyl-2-methyl-isothiourea Formula: C14H20N2O2S2 MolecularWeight: 312.4508

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC1CCCCC1)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CSC(=NC1CCCCC1)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H20N2O2S2/c1-19-14(15-12-8-4-2-5-9-12)16-20(17,18)13-10-6-3-7-11-13/h3,6-7,10-12H,2,4-5,8-9H2,1H3,(H,15,16)