1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(propanoylamino)thiourea

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(propanoylamino)thiourea Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(propanoylamino)thiourea CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-oxopropylamino)thiourea IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(propanoylamino)thiourea Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-propionamido-thiourea Formula: C12H15N3O3S MolecularWeight: 281.3308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NNC(=S)NC1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CCC(=O)NNC(=S)NC1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C12H15N3O3S/c1-2-11(16)14-15-12(19)13-8-3-4-9-10(7-8)18-6-5-17-9/h3-4,7H,2,5-6H2,1H3,(H,14,16)(H2,13,15,19)