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

Systemtic Name: 1-(heptan-4-ylideneamino)-3-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(1-propylbutylideneamino)-3-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-(heptan-4-ylideneamino)-3-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(heptan-4-ylideneamino)-3-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(1-propylbutylideneamino)-3-[2-(trifluoromethyl)phenyl]thiourea Formula: C15H20F3N3S MolecularWeight: 331.39961

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NNC(=S)NC1=CC=CC=C1C(F)(F)F)CCC

Isomeric SMILES

CCCC(=NNC(=S)NC1=CC=CC=C1C(F)(F)F)CCC

InChI

InChI=1S/C15H20F3N3S/c1-3-7-11(8-4-2)20-21-14(22)19-13-10-6-5-9-12(13)15(16,17)18/h5-6,9-10H,3-4,7-8H2,1-2H3,(H2,19,21,22)