1-(1,3-benzodioxol-5-ylcarbonylamino)-3-(3-ethoxypropyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylcarbonylamino)-3-(3-ethoxypropyl)thiourea Openeye Name: 1-(1,3-benzodioxole-5-carbonylamino)-3-(3-ethoxypropyl)thiourea CAS Name: 1-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-3-(3-ethoxypropyl)thiourea IUPAC Name: 1-(1,3-benzodioxole-5-carbonylamino)-3-(3-ethoxypropyl)thiourea Traditional Name: 1-(3-ethoxypropyl)-3-(piperonyloylamino)thiourea Formula: C14H19N3O4S MolecularWeight: 325.38336

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=S)NNC(=O)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCOCCCNC(=S)NNC(=O)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C14H19N3O4S/c1-2-19-7-3-6-15-14(22)17-16-13(18)10-4-5-11-12(8-10)21-9-20-11/h4-5,8H,2-3,6-7,9H2,1H3,(H,16,18)(H2,15,17,22)