1-[[3-fluoranyl-4-(methylsulfonylamino)phenyl]methyl]-3-phenethyl-thiourea

Systemtic Name: 1-[[3-fluoranyl-4-(methylsulfonylamino)phenyl]methyl]-3-phenethyl-thiourea Openeye Name: 1-[[3-fluoro-4-(methanesulfonamido)phenyl]methyl]-3-phenethyl-thiourea CAS Name: 1-[[3-fluoro-4-(methanesulfonamido)phenyl]methyl]-3-phenethylthiourea IUPAC Name: 1-[[3-fluoro-4-(methanesulfonamido)phenyl]methyl]-3-phenethylthiourea Traditional Name: 1-[3-fluoro-4-(methanesulfonamido)benzyl]-3-phenethyl-thiourea Formula: C17H20FN3O2S2 MolecularWeight: 381.488003

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=C(C=C(C=C1)CNC(=S)NCCC2=CC=CC=C2)F

Isomeric SMILES

CS(=O)(=O)NC1=C(C=C(C=C1)CNC(=S)NCCC2=CC=CC=C2)F

InChI

InChI=1S/C17H20FN3O2S2/c1-25(22,23)21-16-8-7-14(11-15(16)18)12-20-17(24)19-10-9-13-5-3-2-4-6-13/h2-8,11,21H,9-10,12H2,1H3,(H2,19,20,24)