(2-methoxyphenyl)methyl N'-butylcarbamimidothioate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN=C(N)SCC1=CC=CC=C1OC

Isomeric SMILES

CCCCN=C(N)SCC1=CC=CC=C1OC

InChI

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