7-[(1-methylimidazol-2-yl)sulfanylmethyl]-2,3-dihydro-1,4-benzodioxin-6-amine

Systemtic Name: 7-[(1-methylimidazol-2-yl)sulfanylmethyl]-2,3-dihydro-1,4-benzodioxin-6-amine Openeye Name: 7-[(1-methylimidazol-2-yl)sulfanylmethyl]-2,3-dihydro-1,4-benzodioxin-6-amine CAS Name: 7-[[(1-methyl-2-imidazolyl)thio]methyl]-2,3-dihydro-1,4-benzodioxin-6-amine IUPAC Name: 7-[(1-methylimidazol-2-yl)sulfanylmethyl]-2,3-dihydro-1,4-benzodioxin-6-amine Traditional Name: [7-[[(1-methylimidazol-2-yl)thio]methyl]-2,3-dihydro-1,4-benzodioxin-6-yl]amine Formula: C13H15N3O2S MolecularWeight: 277.3421

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC2=CC3=C(C=C2N)OCCO3

Isomeric SMILES

CN1C=CN=C1SCC2=CC3=C(C=C2N)OCCO3

InChI

InChI=1S/C13H15N3O2S/c1-16-3-2-15-13(16)19-8-9-6-11-12(7-10(9)14)18-5-4-17-11/h2-3,6-7H,4-5,8,14H2,1H3