1-(1,3-benzodioxol-5-ylmethyl)-3-hexyl-thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-hexyl-thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-hexyl-thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-hexylthiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-hexylthiourea Traditional Name: 1-hexyl-3-piperonyl-thiourea Formula: C15H22N2O2S MolecularWeight: 294.41238

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=S)NCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCCCCCNC(=S)NCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C15H22N2O2S/c1-2-3-4-5-8-16-15(20)17-10-12-6-7-13-14(9-12)19-11-18-13/h6-7,9H,2-5,8,10-11H2,1H3,(H2,16,17,20)