1-[(4-methylphenyl)-phenylazanyl-methylidene]-3-[3-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[(4-methylphenyl)-phenylazanyl-methylidene]-3-[3-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[anilino(p-tolyl)methylene]-3-[3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[anilino-(4-methylphenyl)methylidene]-3-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[anilino-(4-methylphenyl)methylidene]-3-[3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[anilino(p-tolyl)methylene]-3-[3-(trifluoromethyl)phenyl]thiourea Formula: C22H18F3N3S MolecularWeight: 413.45863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=NC(=S)NC2=CC=CC(=C2)C(F)(F)F)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=NC(=S)NC2=CC=CC(=C2)C(F)(F)F)NC3=CC=CC=C3

InChI

InChI=1S/C22H18F3N3S/c1-15-10-12-16(13-11-15)20(26-18-7-3-2-4-8-18)28-21(29)27-19-9-5-6-17(14-19)22(23,24)25/h2-14H,1H3,(H2,26,27,28,29)