1-(2-cyanoethyl)-1-(thiophen-2-ylmethyl)-3-[3-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-(2-cyanoethyl)-1-(thiophen-2-ylmethyl)-3-[3-(trifluoromethyl)phenyl]urea Openeye Name: 1-(2-cyanoethyl)-1-(2-thienylmethyl)-3-[3-(trifluoromethyl)phenyl]urea CAS Name: 1-(2-cyanoethyl)-1-(thiophen-2-ylmethyl)-3-[3-(trifluoromethyl)phenyl]urea IUPAC Name: 1-(2-cyanoethyl)-1-(thiophen-2-ylmethyl)-3-[3-(trifluoromethyl)phenyl]urea Traditional Name: 1-(2-cyanoethyl)-1-(2-thenyl)-3-[3-(trifluoromethyl)phenyl]urea Formula: C16H14F3N3OS MolecularWeight: 353.36207

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)N(CCC#N)CC2=CC=CS2)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)N(CCC#N)CC2=CC=CS2)C(F)(F)F

InChI

InChI=1S/C16H14F3N3OS/c17-16(18,19)12-4-1-5-13(10-12)21-15(23)22(8-3-7-20)11-14-6-2-9-24-14/h1-2,4-6,9-10H,3,8,11H2,(H,21,23)