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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=S)N(CCC#N)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=S)N(CCC#N)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C19H18F3N3S/c1-2-14-6-3-8-16(12-14)24-18(26)25(11-5-10-23)17-9-4-7-15(13-17)19(20,21)22/h3-4,6-9,12-13H,2,5,11H2,1H3,(H,24,26)