1-(2-cyanoethyl)-3-(2-methylprop-2-enyl)-1-[3-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-(2-cyanoethyl)-3-(2-methylprop-2-enyl)-1-[3-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(2-cyanoethyl)-3-(2-methylallyl)-1-[3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-(2-cyanoethyl)-3-(2-methylprop-2-enyl)-1-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(2-cyanoethyl)-3-(2-methylprop-2-enyl)-1-[3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(2-cyanoethyl)-3-(2-methylallyl)-1-[3-(trifluoromethyl)phenyl]thiourea Formula: C15H16F3N3S MolecularWeight: 327.36785

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CNC(=S)N(CCC#N)C1=CC=CC(=C1)C(F)(F)F

Isomeric SMILES

CC(=C)CNC(=S)N(CCC#N)C1=CC=CC(=C1)C(F)(F)F

InChI

InChI=1S/C15H16F3N3S/c1-11(2)10-20-14(22)21(8-4-7-19)13-6-3-5-12(9-13)15(16,17)18/h3,5-6,9H,1,4,8,10H2,2H3,(H,20,22)