methyl N'-[(2-azanyl-6-fluoranyl-phenyl)methyl]-N-cyano-carbamimidothioate

Systemtic Name: methyl N'-[(2-azanyl-6-fluoranyl-phenyl)methyl]-N-cyano-carbamimidothioate Openeye Name: 3-[(2-amino-6-fluoro-phenyl)methyl]-1-cyano-2-methyl-isothiourea CAS Name: N'-[(2-amino-6-fluorophenyl)methyl]-N-cyanocarbamimidothioic acid methyl ester IUPAC Name: methyl N'-[(2-amino-6-fluorophenyl)methyl]-N-cyanocarbamimidothioate Traditional Name: 3-(2-amino-6-fluoro-benzyl)-1-cyano-2-methyl-isothiourea Formula: C10H11FN4S MolecularWeight: 238.284543

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NCC1=C(C=CC=C1F)N)NC#N

Isomeric SMILES

CSC(=NCC1=C(C=CC=C1F)N)NC#N

InChI

InChI=1S/C10H11FN4S/c1-16-10(15-6-12)14-5-7-8(11)3-2-4-9(7)13/h2-4H,5,13H2,1H3,(H,14,15)