(2-oxidanylideneoxolan-3-yl) N'-(4-bromophenyl)carbamimidothioate

Systemtic Name: (2-oxidanylideneoxolan-3-yl) N'-(4-bromophenyl)carbamimidothioate Openeye Name: 3-(4-bromophenyl)-2-(2-oxotetrahydrofuran-3-yl)isothiourea CAS Name: N'-(4-bromophenyl)carbamimidothioic acid (2-oxo-3-oxolanyl) ester IUPAC Name: (2-oxooxolan-3-yl) N'-(4-bromophenyl)carbamimidothioate Traditional Name: 3-(4-bromophenyl)-2-(2-ketotetrahydrofuran-3-yl)isothiourea Formula: C11H11BrN2O2S MolecularWeight: 315.18624

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)C1SC(=NC2=CC=C(C=C2)Br)N

Isomeric SMILES

C1COC(=O)C1SC(=NC2=CC=C(C=C2)Br)N

InChI

InChI=1S/C11H11BrN2O2S/c12-7-1-3-8(4-2-7)14-11(13)17-9-5-6-16-10(9)15/h1-4,9H,5-6H2,(H2,13,14)