1-(1,3-benzodioxol-5-ylmethyl)-3-[(2-fluorophenyl)methyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(2-fluorophenyl)methyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(2-fluorophenyl)methyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(2-fluorophenyl)methyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(2-fluorophenyl)methyl]thiourea Traditional Name: 1-(2-fluorobenzyl)-3-piperonyl-thiourea Formula: C16H15FN2O2S MolecularWeight: 318.365903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=S)NCC3=CC=CC=C3F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=S)NCC3=CC=CC=C3F

InChI

InChI=1S/C16H15FN2O2S/c17-13-4-2-1-3-12(13)9-19-16(22)18-8-11-5-6-14-15(7-11)21-10-20-14/h1-7H,8-10H2,(H2,18,19,22)