1-[3-(dimethylsulfamoyl)phenyl]-3-[2-(phenylmethylsulfanyl)ethyl]thiourea

Systemtic Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-[2-(phenylmethylsulfanyl)ethyl]thiourea Openeye Name: 1-(2-benzylsulfanylethyl)-3-[3-(dimethylsulfamoyl)phenyl]thiourea CAS Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-[2-(phenylmethylthio)ethyl]thiourea IUPAC Name: 1-(2-benzylsulfanylethyl)-3-[3-(dimethylsulfamoyl)phenyl]thiourea Traditional Name: 1-[2-(benzylthio)ethyl]-3-[3-(dimethylsulfamoyl)phenyl]thiourea Formula: C18H23N3O2S3 MolecularWeight: 409.58912

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)NC(=S)NCCSCC2=CC=CC=C2

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)NC(=S)NCCSCC2=CC=CC=C2

InChI

InChI=1S/C18H23N3O2S3/c1-21(2)26(22,23)17-10-6-9-16(13-17)20-18(24)19-11-12-25-14-15-7-4-3-5-8-15/h3-10,13H,11-12,14H2,1-2H3,(H2,19,20,24)