1-(1,3-benzodioxol-5-yl)-3-[2,4-bis(bromanyl)-6-fluoranyl-phenyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[2,4-bis(bromanyl)-6-fluoranyl-phenyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(2,4-dibromo-6-fluoro-phenyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-(2,4-dibromo-6-fluorophenyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(2,4-dibromo-6-fluorophenyl)thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(2,4-dibromo-6-fluoro-phenyl)thiourea Formula: C14H9Br2FN2O2S MolecularWeight: 448.104863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=S)NC3=C(C=C(C=C3F)Br)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=S)NC3=C(C=C(C=C3F)Br)Br

InChI

InChI=1S/C14H9Br2FN2O2S/c15-7-3-9(16)13(10(17)4-7)19-14(22)18-8-1-2-11-12(5-8)21-6-20-11/h1-5H,6H2,(H2,18,19,22)