[1-(4-fluorophenyl)-5-oxidanylidene-pyrrolidin-3-yl]methyl carbamimidothioate

Systemtic Name: [1-(4-fluorophenyl)-5-oxidanylidene-pyrrolidin-3-yl]methyl carbamimidothioate Openeye Name: 2-[[1-(4-fluorophenyl)-5-oxo-pyrrolidin-3-yl]methyl]isothiourea CAS Name: carbamimidothioic acid [1-(4-fluorophenyl)-5-oxo-3-pyrrolidinyl]methyl ester IUPAC Name: [1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]methyl carbamimidothioate Traditional Name: 2-[[1-(4-fluorophenyl)-5-keto-pyrrolidin-3-yl]methyl]isothiourea Formula: C12H14FN3OS MolecularWeight: 267.322463

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC=C(C=C2)F)CSC(=N)N

Isomeric SMILES

C1C(CN(C1=O)C2=CC=C(C=C2)F)CSC(=N)N

InChI

InChI=1S/C12H14FN3OS/c13-9-1-3-10(4-2-9)16-6-8(5-11(16)17)7-18-12(14)15/h1-4,8H,5-7H2,(H3,14,15)