(3-fluorophenyl)methyl N'-[(1R)-1-phenylethyl]carbamimidothioate

Systemtic Name: (3-fluorophenyl)methyl N'-[(1R)-1-phenylethyl]carbamimidothioate Openeye Name: 2-[(3-fluorophenyl)methyl]-3-[(1R)-1-phenylethyl]isothiourea CAS Name: N'-[(1R)-1-phenylethyl]carbamimidothioic acid (3-fluorophenyl)methyl ester IUPAC Name: (3-fluorophenyl)methyl N'-[(1R)-1-phenylethyl]carbamimidothioate Traditional Name: 2-(3-fluorobenzyl)-3-[(1R)-1-phenylethyl]isothiourea Formula: C16H17FN2S MolecularWeight: 288.382983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N=C(N)SCC2=CC(=CC=C2)F

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N=C(N)SCC2=CC(=CC=C2)F

InChI

InChI=1S/C16H17FN2S/c1-12(14-7-3-2-4-8-14)19-16(18)20-11-13-6-5-9-15(17)10-13/h2-10,12H,11H2,1H3,(H2,18,19)/t12-/m1/s1