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(3-methoxyphenyl)methyl N'-butylcarbamimidothioate

(3-methoxyphenyl)methyl N'-butylcarbamimidothioate

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

Canonical SMILES:

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


Isomeric SMILES

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


InChI

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


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