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

Systemtic Name: (4-methylsulfanylphenyl)methyl N'-[[(2R)-oxolan-2-yl]methyl]carbamimidothioate Openeye Name: 2-[(4-methylsulfanylphenyl)methyl]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]isothiourea CAS Name: N'-[[(2R)-2-oxolanyl]methyl]carbamimidothioic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl N'-[[(2R)-oxolan-2-yl]methyl]carbamimidothioate Traditional Name: 2-[4-(methylthio)benzyl]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]isothiourea Formula: C14H20N2OS2 MolecularWeight: 296.4514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CSC(=NCC2CCCO2)N

Isomeric SMILES

CSC1=CC=C(C=C1)CSC(=NC[C@H]2CCCO2)N

InChI

InChI=1S/C14H20N2OS2/c1-18-13-6-4-11(5-7-13)10-19-14(15)16-9-12-3-2-8-17-12/h4-7,12H,2-3,8-10H2,1H3,(H2,15,16)/t12-/m1/s1