1-(2-cyanoethanoylamino)-3-[2-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-(2-cyanoethanoylamino)-3-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[(2-cyanoacetyl)amino]-3-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[(2-cyano-1-oxoethyl)amino]-3-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[(2-cyanoacetyl)amino]-3-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[(2-cyanoacetyl)amino]-3-[2-(trifluoromethyl)phenyl]thiourea Formula: C11H9F3N4OS MolecularWeight: 302.27557

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(F)(F)F)NC(=S)NNC(=O)CC#N

Isomeric SMILES

C1=CC=C(C(=C1)C(F)(F)F)NC(=S)NNC(=O)CC#N

InChI

InChI=1S/C11H9F3N4OS/c12-11(13,14)7-3-1-2-4-8(7)16-10(20)18-17-9(19)5-6-15/h1-4H,5H2,(H,17,19)(H2,16,18,20)