[1-[(3-fluorophenyl)methyl]indol-3-yl] carbamimidothioate hydroiodide

Systemtic Name: [1-[(3-fluorophenyl)methyl]indol-3-yl] carbamimidothioate hydroiodide Openeye Name: 2-[1-[(3-fluorophenyl)methyl]indol-3-yl]isothiourea hydroiodide CAS Name: carbamimidothioic acid [1-[(3-fluorophenyl)methyl]-3-indolyl] ester hydroiodide IUPAC Name: [1-[(3-fluorophenyl)methyl]indol-3-yl] carbamimidothioate hydroiodide Traditional Name: 2-[1-(3-fluorobenzyl)indol-3-yl]isothiourea hydroiodide Formula: C16H15FIN3S MolecularWeight: 427.278273

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CC3=CC(=CC=C3)F)SC(=N)N.I

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CC3=CC(=CC=C3)F)SC(=N)N.I

InChI

InChI=1S/C16H14FN3S.HI/c17-12-5-3-4-11(8-12)9-20-10-15(21-16(18)19)13-6-1-2-7-14(13)20;/h1-8,10H,9H2,(H3,18,19);1H