1-[(4-methylphenyl)carbonylamino]-3-[4-(trifluoromethyloxy)phenyl]thiourea

Systemtic Name: 1-[(4-methylphenyl)carbonylamino]-3-[4-(trifluoromethyloxy)phenyl]thiourea Openeye Name: 1-[(4-methylbenzoyl)amino]-3-[4-(trifluoromethoxy)phenyl]thiourea CAS Name: 1-[[(4-methylphenyl)-oxomethyl]amino]-3-[4-(trifluoromethoxy)phenyl]thiourea IUPAC Name: 1-[(4-methylbenzoyl)amino]-3-[4-(trifluoromethoxy)phenyl]thiourea Traditional Name: 1-(p-toluoylamino)-3-[4-(trifluoromethoxy)phenyl]thiourea Formula: C16H14F3N3O2S MolecularWeight: 369.36147

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NNC(=S)NC2=CC=C(C=C2)OC(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NNC(=S)NC2=CC=C(C=C2)OC(F)(F)F

InChI

InChI=1S/C16H14F3N3O2S/c1-10-2-4-11(5-3-10)14(23)21-22-15(25)20-12-6-8-13(9-7-12)24-16(17,18)19/h2-9H,1H3,(H,21,23)(H2,20,22,25)