3-(1,3-benzodioxol-5-ylmethyl)-1-ethyl-1-(4-fluorophenyl)thiourea

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-ethyl-1-(4-fluorophenyl)thiourea Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-ethyl-1-(4-fluorophenyl)thiourea CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-ethyl-1-(4-fluorophenyl)thiourea IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-ethyl-1-(4-fluorophenyl)thiourea Traditional Name: 1-ethyl-1-(4-fluorophenyl)-3-piperonyl-thiourea Formula: C17H17FN2O2S MolecularWeight: 332.392483

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)F)C(=S)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCN(C1=CC=C(C=C1)F)C(=S)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H17FN2O2S/c1-2-20(14-6-4-13(18)5-7-14)17(23)19-10-12-3-8-15-16(9-12)22-11-21-15/h3-9H,2,10-11H2,1H3,(H,19,23)