(4-bromophenyl)methyl N'-[[(2R)-oxolan-2-yl]methyl]carbamimidothioate

Systemtic Name: (4-bromophenyl)methyl N'-[[(2R)-oxolan-2-yl]methyl]carbamimidothioate Openeye Name: 2-[(4-bromophenyl)methyl]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]isothiourea CAS Name: N'-[[(2R)-2-oxolanyl]methyl]carbamimidothioic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl N'-[[(2R)-oxolan-2-yl]methyl]carbamimidothioate Traditional Name: 2-(4-bromobenzyl)-3-[[(2R)-tetrahydrofuran-2-yl]methyl]isothiourea Formula: C13H17BrN2OS MolecularWeight: 329.25588

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN=C(N)SCC2=CC=C(C=C2)Br

Isomeric SMILES

C1C[C@@H](OC1)CN=C(N)SCC2=CC=C(C=C2)Br

InChI

InChI=1S/C13H17BrN2OS/c14-11-5-3-10(4-6-11)9-18-13(15)16-8-12-2-1-7-17-12/h3-6,12H,1-2,7-9H2,(H2,15,16)/t12-/m1/s1