1-[5-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1,2,4-thiadiazol-3-yl]propan-2-one

Systemtic Name: 1-[5-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1,2,4-thiadiazol-3-yl]propan-2-one Openeye Name: 1-[5-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1,2,4-thiadiazol-3-yl]propan-2-one CAS Name: 1-[5-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1,2,4-thiadiazol-3-yl]-2-propanone IUPAC Name: 1-[5-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1,2,4-thiadiazol-3-yl]propan-2-one Traditional Name: 1-[5-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1,2,4-thiadiazol-3-yl]acetone Formula: C13H13N3O3S MolecularWeight: 291.32562

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=NSC(=N1)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(=O)CC1=NSC(=N1)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C13H13N3O3S/c1-8(17)6-12-15-13(20-16-12)14-9-2-3-10-11(7-9)19-5-4-18-10/h2-3,7H,4-6H2,1H3,(H,14,15,16)