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

Systemtic Name: 1-(butanoylamino)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea Openeye Name: 1-(butanoylamino)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-oxobutylamino)thiourea IUPAC Name: 1-(butanoylamino)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea Traditional Name: 1-butyramido-3-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea Formula: C13H17N3O3S MolecularWeight: 295.35738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O3S/c1-2-3-12(17)15-16-13(20)14-9-4-5-10-11(8-9)19-7-6-18-10/h4-5,8H,2-3,6-7H2,1H3,(H,15,17)(H2,14,16,20)