1-(1,3-benzodioxol-5-ylmethyl)-3-(2,4-dimethoxyphenyl)-1-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2,4-dimethoxyphenyl)-1-(oxolan-2-ylmethyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2,4-dimethoxyphenyl)-1-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2,4-dimethoxyphenyl)-1-(2-oxolanylmethyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2,4-dimethoxyphenyl)-1-(oxolan-2-ylmethyl)thiourea Traditional Name: 3-(2,4-dimethoxyphenyl)-1-piperonyl-1-(tetrahydrofurfuryl)thiourea Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=S)N(CC2CCCO2)CC3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=S)N(CC2CCCO2)CC3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C22H26N2O5S/c1-25-16-6-7-18(20(11-16)26-2)23-22(30)24(13-17-4-3-9-27-17)12-15-5-8-19-21(10-15)29-14-28-19/h5-8,10-11,17H,3-4,9,12-14H2,1-2H3,(H,23,30)