3-(1,3-benzodioxol-5-ylmethyl)-1-ethyl-1-(2-hydroxyethyl)thiourea

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-ethyl-1-(2-hydroxyethyl)thiourea Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-ethyl-1-(2-hydroxyethyl)thiourea CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-ethyl-1-(2-hydroxyethyl)thiourea IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-ethyl-1-(2-hydroxyethyl)thiourea Traditional Name: 1-ethyl-1-(2-hydroxyethyl)-3-piperonyl-thiourea Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCO)C(=S)NCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCN(CCO)C(=S)NCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C13H18N2O3S/c1-2-15(5-6-16)13(19)14-8-10-3-4-11-12(7-10)18-9-17-11/h3-4,7,16H,2,5-6,8-9H2,1H3,(H,14,19)