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

Systemtic Name: (3-chlorophenyl)methyl N'-[(1R)-1-phenylethyl]carbamimidothioate Openeye Name: 2-[(3-chlorophenyl)methyl]-3-[(1R)-1-phenylethyl]isothiourea CAS Name: N'-[(1R)-1-phenylethyl]carbamimidothioic acid (3-chlorophenyl)methyl ester IUPAC Name: (3-chlorophenyl)methyl N'-[(1R)-1-phenylethyl]carbamimidothioate Traditional Name: 2-(3-chlorobenzyl)-3-[(1R)-1-phenylethyl]isothiourea Formula: C16H17ClN2S MolecularWeight: 304.83758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17ClN2S/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