1-(1,3-benzodioxol-5-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea Traditional Name: 1-piperonyl-3-(3,4,5-trimethoxyphenyl)thiourea Formula: C18H20N2O5S MolecularWeight: 376.4268

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=S)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=S)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H20N2O5S/c1-21-15-7-12(8-16(22-2)17(15)23-3)20-18(26)19-9-11-4-5-13-14(6-11)25-10-24-13/h4-8H,9-10H2,1-3H3,(H2,19,20,26)