1-(1,3-benzodioxol-5-ylmethyl)-3-(2,4-dimethoxyphenyl)-1-[(4-methoxyphenyl)methyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2,4-dimethoxyphenyl)-1-[(4-methoxyphenyl)methyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2,4-dimethoxyphenyl)-1-[(4-methoxyphenyl)methyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2,4-dimethoxyphenyl)-1-[(4-methoxyphenyl)methyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2,4-dimethoxyphenyl)-1-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 3-(2,4-dimethoxyphenyl)-1-p-anisyl-1-piperonyl-thiourea Formula: C25H26N2O5S MolecularWeight: 466.54934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(CC2=CC3=C(C=C2)OCO3)C(=S)NC4=C(C=C(C=C4)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)CN(CC2=CC3=C(C=C2)OCO3)C(=S)NC4=C(C=C(C=C4)OC)OC

InChI

InChI=1S/C25H26N2O5S/c1-28-19-7-4-17(5-8-19)14-27(15-18-6-11-22-24(12-18)32-16-31-22)25(33)26-21-10-9-20(29-2)13-23(21)30-3/h4-13H,14-16H2,1-3H3,(H,26,33)