(4-butyl-5-oxidanylidene-oxolan-2-yl)methyl carbamimidothioate hydrobromide

Systemtic Name: (4-butyl-5-oxidanylidene-oxolan-2-yl)methyl carbamimidothioate hydrobromide Openeye Name: 2-[(4-butyl-5-oxo-tetrahydrofuran-2-yl)methyl]isothiourea hydrobromide CAS Name: carbamimidothioic acid (4-butyl-5-oxo-2-oxolanyl)methyl ester hydrobromide IUPAC Name: (4-butyl-5-oxooxolan-2-yl)methyl carbamimidothioate hydrobromide Traditional Name: 2-[(4-butyl-5-keto-tetrahydrofuran-2-yl)methyl]isothiourea hydrobromide Formula: C10H19BrN2O2S MolecularWeight: 311.23906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC(OC1=O)CSC(=N)N.Br

Isomeric SMILES

CCCCC1CC(OC1=O)CSC(=N)N.Br

InChI

InChI=1S/C10H18N2O2S.BrH/c1-2-3-4-7-5-8(14-9(7)13)6-15-10(11)12;/h7-8H,2-6H2,1H3,(H3,11,12);1H