1-(1,3-benzodioxol-5-ylmethyl)-3-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]urea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]urea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]urea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-[(2-fluorophenyl)methylthio]ethyl]urea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]urea Traditional Name: 1-[2-[(2-fluorobenzyl)thio]ethyl]-3-piperonyl-urea Formula: C18H19FN2O3S MolecularWeight: 362.418463

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)NCCSCC3=CC=CC=C3F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)NCCSCC3=CC=CC=C3F

InChI

InChI=1S/C18H19FN2O3S/c19-15-4-2-1-3-14(15)11-25-8-7-20-18(22)21-10-13-5-6-16-17(9-13)24-12-23-16/h1-6,9H,7-8,10-12H2,(H2,20,21,22)