(2-chloranyl-6-fluoranyl-phenyl)methyl N'-prop-2-enylcarbamimidothioate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl N'-prop-2-enylcarbamimidothioate Openeye Name: 3-allyl-2-[(2-chloro-6-fluoro-phenyl)methyl]isothiourea CAS Name: N'-prop-2-enylcarbamimidothioic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl N'-prop-2-enylcarbamimidothioate Traditional Name: 3-allyl-2-(2-chloro-6-fluoro-benzyl)isothiourea Formula: C11H12ClFN2S MolecularWeight: 258.742783

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN=C(N)SCC1=C(C=CC=C1Cl)F

Isomeric SMILES

C=CCN=C(N)SCC1=C(C=CC=C1Cl)F

InChI

InChI=1S/C11H12ClFN2S/c1-2-6-15-11(14)16-7-8-9(12)4-3-5-10(8)13/h2-5H,1,6-7H2,(H2,14,15)