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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=S)NCC2=CC(=C(C=C2)NS(=O)(=O)C)F

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=S)NCC2=CC(=C(C=C2)NS(=O)(=O)C)F

InChI

InChI=1S/C17H20FN3O2S2/c1-12-4-3-5-13(8-12)10-19-17(24)20-11-14-6-7-16(15(18)9-14)21-25(2,22)23/h3-9,21H,10-11H2,1-2H3,(H2,19,20,24)