(phenylmethyl) N,N'-dicyclohexylcarbamimidothioate

Systemtic Name: (phenylmethyl) N,N'-dicyclohexylcarbamimidothioate Openeye Name: 2-benzyl-1,3-dicyclohexyl-isothiourea CAS Name: N,N'-dicyclohexylcarbamimidothioic acid (phenylmethyl) ester IUPAC Name: benzyl N,N'-dicyclohexylcarbamimidothioate Traditional Name: 2-benzyl-1,3-dicyclohexyl-isothiourea Formula: C20H30N2S MolecularWeight: 330.5306

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=NC2CCCCC2)SCC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)NC(=NC2CCCCC2)SCC3=CC=CC=C3

InChI

InChI=1S/C20H30N2S/c1-4-10-17(11-5-1)16-23-20(21-18-12-6-2-7-13-18)22-19-14-8-3-9-15-19/h1,4-5,10-11,18-19H,2-3,6-9,12-16H2,(H,21,22)