1-(1,3-benzodioxol-5-ylmethyl)-3-(2-tert-butylsulfanylethyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-tert-butylsulfanylethyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-tert-butylsulfanylethyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(tert-butylthio)ethyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-tert-butylsulfanylethyl)thiourea Traditional Name: 1-[2-(tert-butylthio)ethyl]-3-piperonyl-thiourea Formula: C15H22N2O2S2 MolecularWeight: 326.47738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O2S2/c1-15(2,3)21-7-6-16-14(20)17-9-11-4-5-12-13(8-11)19-10-18-12/h4-5,8H,6-7,9-10H2,1-3H3,(H2,16,17,20)