3-(3-chloranyl-4-fluoranyl-phenyl)-1,1-bis(phenylmethyl)thiourea

Systemtic Name: 3-(3-chloranyl-4-fluoranyl-phenyl)-1,1-bis(phenylmethyl)thiourea Openeye Name: 1,1-dibenzyl-3-(3-chloro-4-fluoro-phenyl)thiourea CAS Name: 3-(3-chloro-4-fluorophenyl)-1,1-bis(phenylmethyl)thiourea IUPAC Name: 1,1-dibenzyl-3-(3-chloro-4-fluorophenyl)thiourea Traditional Name: 1,1-dibenzyl-3-(3-chloro-4-fluoro-phenyl)thiourea Formula: C21H18ClFN2S MolecularWeight: 384.897423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C21H18ClFN2S/c22-19-13-18(11-12-20(19)23)24-21(26)25(14-16-7-3-1-4-8-16)15-17-9-5-2-6-10-17/h1-13H,14-15H2,(H,24,26)