1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(2-fluoranylphenoxy)ethyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(2-fluoranylphenoxy)ethyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(2-fluorophenoxy)ethyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(2-fluorophenoxy)ethyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(2-fluorophenoxy)ethyl]thiourea Traditional Name: 1-[2-(2-fluorophenoxy)ethyl]-3-piperonyl-thiourea Formula: C17H17FN2O3S MolecularWeight: 348.391883

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=S)NCCOC3=CC=CC=C3F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=S)NCCOC3=CC=CC=C3F

InChI

InChI=1S/C17H17FN2O3S/c18-13-3-1-2-4-14(13)21-8-7-19-17(24)20-10-12-5-6-15-16(9-12)23-11-22-15/h1-6,9H,7-8,10-11H2,(H2,19,20,24)