1-propan-2-yl-3-[[4-(trifluoromethylsulfanyl)phenyl]carbonylamino]thiourea

Systemtic Name: 1-propan-2-yl-3-[[4-(trifluoromethylsulfanyl)phenyl]carbonylamino]thiourea Openeye Name: 1-isopropyl-3-[[4-(trifluoromethylsulfanyl)benzoyl]amino]thiourea CAS Name: 1-[[oxo-[4-(trifluoromethylthio)phenyl]methyl]amino]-3-propan-2-ylthiourea IUPAC Name: 1-propan-2-yl-3-[[4-(trifluoromethylsulfanyl)benzoyl]amino]thiourea Traditional Name: 1-isopropyl-3-[[4-(trifluoromethylthio)benzoyl]amino]thiourea Formula: C12H14F3N3OS2 MolecularWeight: 337.38427

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NNC(=O)C1=CC=C(C=C1)SC(F)(F)F

Isomeric SMILES

CC(C)NC(=S)NNC(=O)C1=CC=C(C=C1)SC(F)(F)F

InChI

InChI=1S/C12H14F3N3OS2/c1-7(2)16-11(20)18-17-10(19)8-3-5-9(6-4-8)21-12(13,14)15/h3-7H,1-2H3,(H,17,19)(H2,16,18,20)