(3-methoxyphenyl)methyl N'-tert-butylcarbamimidothioate

Systemtic Name: (3-methoxyphenyl)methyl N'-tert-butylcarbamimidothioate Openeye Name: 3-tert-butyl-2-[(3-methoxyphenyl)methyl]isothiourea CAS Name: N'-tert-butylcarbamimidothioic acid (3-methoxyphenyl)methyl ester IUPAC Name: (3-methoxyphenyl)methyl N'-tert-butylcarbamimidothioate Traditional Name: 3-tert-butyl-2-m-anisyl-isothiourea Formula: C13H20N2OS MolecularWeight: 252.3757

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2OS/c1-13(2,3)15-12(14)17-9-10-6-5-7-11(8-10)16-4/h5-8H,9H2,1-4H3,(H2,14,15)