2-(3-bromanylphenoxy)ethyl N'-(phenylmethyl)carbamimidothioate

Systemtic Name: 2-(3-bromanylphenoxy)ethyl N'-(phenylmethyl)carbamimidothioate Openeye Name: 3-benzyl-2-[2-(3-bromophenoxy)ethyl]isothiourea CAS Name: N'-(phenylmethyl)carbamimidothioic acid 2-(3-bromophenoxy)ethyl ester IUPAC Name: 2-(3-bromophenoxy)ethyl N'-benzylcarbamimidothioate Traditional Name: 3-benzyl-2-[2-(3-bromophenoxy)ethyl]isothiourea Formula: C16H17BrN2OS MolecularWeight: 365.28798

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN=C(N)SCCOC2=CC(=CC=C2)Br

Isomeric SMILES

C1=CC=C(C=C1)CN=C(N)SCCOC2=CC(=CC=C2)Br

InChI

InChI=1S/C16H17BrN2OS/c17-14-7-4-8-15(11-14)20-9-10-21-16(18)19-12-13-5-2-1-3-6-13/h1-8,11H,9-10,12H2,(H2,18,19)