2-(4-chlorophenyl)sulfanylethyl N'-(phenylmethyl)carbamimidothioate

Systemtic Name: 2-(4-chlorophenyl)sulfanylethyl N'-(phenylmethyl)carbamimidothioate Openeye Name: 3-benzyl-2-[2-(4-chlorophenyl)sulfanylethyl]isothiourea CAS Name: N'-(phenylmethyl)carbamimidothioic acid 2-[(4-chlorophenyl)thio]ethyl ester IUPAC Name: 2-(4-chlorophenyl)sulfanylethyl N'-benzylcarbamimidothioate Traditional Name: 3-benzyl-2-[2-[(4-chlorophenyl)thio]ethyl]isothiourea Formula: C16H17ClN2S2 MolecularWeight: 336.90258

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN=C(N)SCCSC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN=C(N)SCCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H17ClN2S2/c17-14-6-8-15(9-7-14)20-10-11-21-16(18)19-12-13-4-2-1-3-5-13/h1-9H,10-12H2,(H2,18,19)