1-[4-chloranyl-3-(trifluoromethyl)phenyl]-3-[(4-dimethylaminophenyl)methyl]thiourea

Systemtic Name: 1-[4-chloranyl-3-(trifluoromethyl)phenyl]-3-[(4-dimethylaminophenyl)methyl]thiourea Openeye Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[(4-dimethylaminophenyl)methyl]thiourea CAS Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[(4-dimethylaminophenyl)methyl]thiourea IUPAC Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[(4-dimethylaminophenyl)methyl]thiourea Traditional Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[4-(dimethylamino)benzyl]thiourea Formula: C17H17ClF3N3S MolecularWeight: 387.85019

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNC(=S)NC2=CC(=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC(=S)NC2=CC(=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C17H17ClF3N3S/c1-24(2)13-6-3-11(4-7-13)10-22-16(25)23-12-5-8-15(18)14(9-12)17(19,20)21/h3-9H,10H2,1-2H3,(H2,22,23,25)