1-(1,3-benzodioxol-5-ylmethyl)-3-tert-butyl-thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-tert-butyl-thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-tert-butyl-thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-tert-butylthiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-tert-butylthiourea Traditional Name: 1-tert-butyl-3-piperonyl-thiourea Formula: C13H18N2O2S MolecularWeight: 266.35922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(C)(C)NC(=S)NCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C13H18N2O2S/c1-13(2,3)15-12(18)14-7-9-4-5-10-11(6-9)17-8-16-10/h4-6H,7-8H2,1-3H3,(H2,14,15,18)