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

Systemtic Name: 1-(2-cyanoethyl)-3-phenethyl-1-[3-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(2-cyanoethyl)-3-phenethyl-1-[3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-(2-cyanoethyl)-3-phenethyl-1-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(2-cyanoethyl)-3-phenethyl-1-[3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(2-cyanoethyl)-3-phenethyl-1-[3-(trifluoromethyl)phenyl]thiourea Formula: C19H18F3N3S MolecularWeight: 377.42653

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=S)N(CCC#N)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=S)N(CCC#N)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C19H18F3N3S/c20-19(21,22)16-8-4-9-17(14-16)25(13-5-11-23)18(26)24-12-10-15-6-2-1-3-7-15/h1-4,6-9,14H,5,10,12-13H2,(H,24,26)