1-(anthracen-9-ylmethyl)-3-[[3-fluoranyl-4-(methylsulfonylamino)phenyl]methyl]thiourea

Systemtic Name: 1-(anthracen-9-ylmethyl)-3-[[3-fluoranyl-4-(methylsulfonylamino)phenyl]methyl]thiourea Openeye Name: 1-(9-anthrylmethyl)-3-[[3-fluoro-4-(methanesulfonamido)phenyl]methyl]thiourea CAS Name: 1-(9-anthracenylmethyl)-3-[[3-fluoro-4-(methanesulfonamido)phenyl]methyl]thiourea IUPAC Name: 1-(anthracen-9-ylmethyl)-3-[[3-fluoro-4-(methanesulfonamido)phenyl]methyl]thiourea Traditional Name: 1-(9-anthrylmethyl)-3-[3-fluoro-4-(methanesulfonamido)benzyl]thiourea Formula: C24H22FN3O2S2 MolecularWeight: 467.578783

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=C(C=C(C=C1)CNC(=S)NCC2=C3C=CC=CC3=CC4=CC=CC=C42)F

Isomeric SMILES

CS(=O)(=O)NC1=C(C=C(C=C1)CNC(=S)NCC2=C3C=CC=CC3=CC4=CC=CC=C42)F

InChI

InChI=1S/C24H22FN3O2S2/c1-32(29,30)28-23-11-10-16(12-22(23)25)14-26-24(31)27-15-21-19-8-4-2-6-17(19)13-18-7-3-5-9-20(18)21/h2-13,28H,14-15H2,1H3,(H2,26,27,31)