1-(4-butylphenyl)-3-[2-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(4-butylphenyl)-3-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-(4-butylphenyl)-3-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(4-butylphenyl)-3-[2-(trifluoromethyl)phenyl]thiourea Formula: C18H19F3N2S MolecularWeight: 352.41707

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NC2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NC2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C18H19F3N2S/c1-2-3-6-13-9-11-14(12-10-13)22-17(24)23-16-8-5-4-7-15(16)18(19,20)21/h4-5,7-12H,2-3,6H2,1H3,(H2,22,23,24)