1-(1,3-benzodioxol-5-yl)-3-[(5-bromanyl-2-fluoranyl-phenyl)methyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[(5-bromanyl-2-fluoranyl-phenyl)methyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[(5-bromo-2-fluoro-phenyl)methyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[(5-bromo-2-fluorophenyl)methyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[(5-bromo-2-fluorophenyl)methyl]thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(5-bromo-2-fluoro-benzyl)thiourea Formula: C15H12BrFN2O2S MolecularWeight: 383.235383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=S)NCC3=C(C=CC(=C3)Br)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=S)NCC3=C(C=CC(=C3)Br)F

InChI

InChI=1S/C15H12BrFN2O2S/c16-10-1-3-12(17)9(5-10)7-18-15(22)19-11-2-4-13-14(6-11)21-8-20-13/h1-6H,7-8H2,(H2,18,19,22)