3-(1,3-benzodioxol-5-yl)-1,1-diethyl-thiourea

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1,1-diethyl-thiourea Openeye Name: 3-(1,3-benzodioxol-5-yl)-1,1-diethyl-thiourea CAS Name: 3-(1,3-benzodioxol-5-yl)-1,1-diethylthiourea IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1,1-diethylthiourea Traditional Name: 3-(1,3-benzodioxol-5-yl)-1,1-diethyl-thiourea Formula: C12H16N2O2S MolecularWeight: 252.33264

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O2S/c1-3-14(4-2)12(17)13-9-5-6-10-11(7-9)16-8-15-10/h5-7H,3-4,8H2,1-2H3,(H,13,17)