1-[4-hex-1-ynyl-3-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[4-hex-1-ynyl-3-(trifluoromethyl)phenyl]thiourea Openeye Name: [4-hex-1-ynyl-3-(trifluoromethyl)phenyl]thiourea CAS Name: [4-hex-1-ynyl-3-(trifluoromethyl)phenyl]thiourea IUPAC Name: [4-hex-1-ynyl-3-(trifluoromethyl)phenyl]thiourea Traditional Name: [4-hex-1-ynyl-3-(trifluoromethyl)phenyl]thiourea Formula: C14H15F3N2S MolecularWeight: 300.34251

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=C(C=C(C=C1)NC(=S)N)C(F)(F)F

Isomeric SMILES

CCCCC#CC1=C(C=C(C=C1)NC(=S)N)C(F)(F)F

InChI

InChI=1S/C14H15F3N2S/c1-2-3-4-5-6-10-7-8-11(19-13(18)20)9-12(10)14(15,16)17/h7-9H,2-4H2,1H3,(H3,18,19,20)