methyl N-(4-chlorophenyl)-N'-[(1R)-1-phenylethyl]carbamimidothioate

Systemtic Name: methyl N-(4-chlorophenyl)-N'-[(1R)-1-phenylethyl]carbamimidothioate Openeye Name: 1-(4-chlorophenyl)-2-methyl-3-[(1R)-1-phenylethyl]isothiourea CAS Name: N-(4-chlorophenyl)-N'-[(1R)-1-phenylethyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N-(4-chlorophenyl)-N'-[(1R)-1-phenylethyl]carbamimidothioate Traditional Name: 1-(4-chlorophenyl)-2-methyl-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(NC2=CC=C(C=C2)Cl)SC

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N=C(NC2=CC=C(C=C2)Cl)SC

InChI

InChI=1S/C16H17ClN2S/c1-12(13-6-4-3-5-7-13)18-16(20-2)19-15-10-8-14(17)9-11-15/h3-12H,1-2H3,(H,18,19)/t12-/m1/s1