(3-fluorophenyl)methyl N'-[(2R)-1-methoxypropan-2-yl]carbamimidothioate

Systemtic Name: (3-fluorophenyl)methyl N'-[(2R)-1-methoxypropan-2-yl]carbamimidothioate Openeye Name: 2-[(3-fluorophenyl)methyl]-3-[(1R)-2-methoxy-1-methyl-ethyl]isothiourea CAS Name: N'-[(2R)-1-methoxypropan-2-yl]carbamimidothioic acid (3-fluorophenyl)methyl ester IUPAC Name: (3-fluorophenyl)methyl N'-[(2R)-1-methoxypropan-2-yl]carbamimidothioate Traditional Name: 2-(3-fluorobenzyl)-3-[(1R)-2-methoxy-1-methyl-ethyl]isothiourea Formula: C12H17FN2OS MolecularWeight: 256.339583

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)N=C(N)SCC1=CC(=CC=C1)F

Isomeric SMILES

C[C@H](COC)N=C(N)SCC1=CC(=CC=C1)F

InChI

InChI=1S/C12H17FN2OS/c1-9(7-16-2)15-12(14)17-8-10-4-3-5-11(13)6-10/h3-6,9H,7-8H2,1-2H3,(H2,14,15)/t9-/m1/s1