(phenylmethyl) N'-tert-butylcarbamimidothioate

Systemtic Name: (phenylmethyl) N'-tert-butylcarbamimidothioate Openeye Name: 2-benzyl-3-tert-butyl-isothiourea CAS Name: N'-tert-butylcarbamimidothioic acid (phenylmethyl) ester IUPAC Name: benzyl N'-tert-butylcarbamimidothioate Traditional Name: 2-benzyl-3-tert-butyl-isothiourea Formula: C12H18N2S MolecularWeight: 222.34972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N=C(N)SCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)N=C(N)SCC1=CC=CC=C1

InChI

InChI=1S/C12H18N2S/c1-12(2,3)14-11(13)15-9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3,(H2,13,14)