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

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-(2-tert-butylsulfanylethyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(2-tert-butylsulfanylethyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(tert-butylthio)ethyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(2-tert-butylsulfanylethyl)thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(tert-butylthio)ethyl]thiourea Formula: C14H20N2O2S2 MolecularWeight: 312.4508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCCNC(=S)NC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(C)(C)SCCNC(=S)NC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C14H20N2O2S2/c1-14(2,3)20-7-6-15-13(19)16-10-4-5-11-12(8-10)18-9-17-11/h4-5,8H,6-7,9H2,1-3H3,(H2,15,16,19)