1-(4-bromophenyl)-3-[2-(phenylmethylsulfanyl)ethyl]urea

Systemtic Name: 1-(4-bromophenyl)-3-[2-(phenylmethylsulfanyl)ethyl]urea Openeye Name: 1-(2-benzylsulfanylethyl)-3-(4-bromophenyl)urea CAS Name: 1-(4-bromophenyl)-3-[2-(phenylmethylthio)ethyl]urea IUPAC Name: 1-(2-benzylsulfanylethyl)-3-(4-bromophenyl)urea Traditional Name: 1-[2-(benzylthio)ethyl]-3-(4-bromophenyl)urea Formula: C16H17BrN2OS MolecularWeight: 365.28798

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCNC(=O)NC2=CC=C(C=C2)Br

Isomeric SMILES

C1=CC=C(C=C1)CSCCNC(=O)NC2=CC=C(C=C2)Br

InChI

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