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

Systemtic Name: 1-(2-cyanoethyl)-3-(2-methoxyethyl)-1-[3-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(2-cyanoethyl)-3-(2-methoxyethyl)-1-[3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-(2-cyanoethyl)-3-(2-methoxyethyl)-1-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(2-cyanoethyl)-3-(2-methoxyethyl)-1-[3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(2-cyanoethyl)-3-(2-methoxyethyl)-1-[3-(trifluoromethyl)phenyl]thiourea Formula: C14H16F3N3OS MolecularWeight: 331.35655

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16F3N3OS/c1-21-9-7-19-13(22)20(8-3-6-18)12-5-2-4-11(10-12)14(15,16)17/h2,4-5,10H,3,7-9H2,1H3,(H,19,22)