1-(1,3-benzodioxol-5-ylmethyl)-3-(2-ethoxyphenyl)-1-[(4-fluorophenyl)methyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-ethoxyphenyl)-1-[(4-fluorophenyl)methyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-ethoxyphenyl)-1-[(4-fluorophenyl)methyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-ethoxyphenyl)-1-[(4-fluorophenyl)methyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-ethoxyphenyl)-1-[(4-fluorophenyl)methyl]thiourea Traditional Name: 1-(4-fluorobenzyl)-3-o-phenetyl-1-piperonyl-thiourea Formula: C24H23FN2O3S MolecularWeight: 438.514423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=S)N(CC2=CC=C(C=C2)F)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC1=CC=CC=C1NC(=S)N(CC2=CC=C(C=C2)F)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H23FN2O3S/c1-2-28-21-6-4-3-5-20(21)26-24(31)27(14-17-7-10-19(25)11-8-17)15-18-9-12-22-23(13-18)30-16-29-22/h3-13H,2,14-16H2,1H3,(H,26,31)