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

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(4-methoxyphenyl)methyl]-1-(pyridin-2-ylmethyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(4-methoxyphenyl)methyl]-1-(2-pyridylmethyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(4-methoxyphenyl)methyl]-1-(2-pyridinylmethyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(4-methoxyphenyl)methyl]-1-(pyridin-2-ylmethyl)thiourea Traditional Name: 3-p-anisyl-1-piperonyl-1-(2-pyridylmethyl)thiourea Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CC=N4

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CC=N4

InChI

InChI=1S/C23H23N3O3S/c1-27-20-8-5-17(6-9-20)13-25-23(30)26(15-19-4-2-3-11-24-19)14-18-7-10-21-22(12-18)29-16-28-21/h2-12H,13-16H2,1H3,(H,25,30)