1-(4-tert-butylphenyl)-3-[[4-chloranyl-3-(trifluoromethyl)phenyl]methyl]thiourea

Systemtic Name: 1-(4-tert-butylphenyl)-3-[[4-chloranyl-3-(trifluoromethyl)phenyl]methyl]thiourea Openeye Name: 1-(4-tert-butylphenyl)-3-[[4-chloro-3-(trifluoromethyl)phenyl]methyl]thiourea CAS Name: 1-(4-tert-butylphenyl)-3-[[4-chloro-3-(trifluoromethyl)phenyl]methyl]thiourea IUPAC Name: 1-(4-tert-butylphenyl)-3-[[4-chloro-3-(trifluoromethyl)phenyl]methyl]thiourea Traditional Name: 1-(4-tert-butylphenyl)-3-[4-chloro-3-(trifluoromethyl)benzyl]thiourea Formula: C19H20ClF3N2S MolecularWeight: 400.88871

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=S)NCC2=CC(=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=S)NCC2=CC(=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C19H20ClF3N2S/c1-18(2,3)13-5-7-14(8-6-13)25-17(26)24-11-12-4-9-16(20)15(10-12)19(21,22)23/h4-10H,11H2,1-3H3,(H2,24,25,26)