1-(1,3-benzodioxol-5-ylmethyl)-3-(2-ethoxyphenyl)-1-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-ethoxyphenyl)-1-(oxolan-2-ylmethyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-ethoxyphenyl)-1-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-ethoxyphenyl)-1-(2-oxolanylmethyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-ethoxyphenyl)-1-(oxolan-2-ylmethyl)thiourea Traditional Name: 3-o-phenetyl-1-piperonyl-1-(tetrahydrofurfuryl)thiourea Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=S)N(CC2CCCO2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC1=CC=CC=C1NC(=S)N(CC2CCCO2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H26N2O4S/c1-2-25-19-8-4-3-7-18(19)23-22(29)24(14-17-6-5-11-26-17)13-16-9-10-20-21(12-16)28-15-27-20/h3-4,7-10,12,17H,2,5-6,11,13-15H2,1H3,(H,23,29)