1-tert-butyl-3-[2-chloranyl-5-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-tert-butyl-3-[2-chloranyl-5-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-tert-butyl-3-[2-chloro-5-(trifluoromethyl)phenyl]thiourea CAS Name: 1-tert-butyl-3-[2-chloro-5-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-tert-butyl-3-[2-chloro-5-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-tert-butyl-3-[2-chloro-5-(trifluoromethyl)phenyl]thiourea Formula: C12H14ClF3N2S MolecularWeight: 310.76617

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NC1=C(C=CC(=C1)C(F)(F)F)Cl

Isomeric SMILES

CC(C)(C)NC(=S)NC1=C(C=CC(=C1)C(F)(F)F)Cl

InChI

InChI=1S/C12H14ClF3N2S/c1-11(2,3)18-10(19)17-9-6-7(12(14,15)16)4-5-8(9)13/h4-6H,1-3H3,(H2,17,18,19)