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

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-ethyl-1-[(4-fluorophenyl)methyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-ethyl-1-[(4-fluorophenyl)methyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-ethyl-1-[(4-fluorophenyl)methyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-ethyl-1-[(4-fluorophenyl)methyl]thiourea Traditional Name: 3-ethyl-1-(4-fluorobenzyl)-1-piperonyl-thiourea Formula: C18H19FN2O2S MolecularWeight: 346.419063

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N(CC1=CC=C(C=C1)F)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCNC(=S)N(CC1=CC=C(C=C1)F)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H19FN2O2S/c1-2-20-18(24)21(10-13-3-6-15(19)7-4-13)11-14-5-8-16-17(9-14)23-12-22-16/h3-9H,2,10-12H2,1H3,(H,20,24)