2-[2-azanyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-5-yl]ethylazanium

Systemtic Name: 2-[2-azanyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-5-yl]ethylazanium Openeye Name: 2-[2-amino-4-(2,3-dihydro-1,4-benzodioxin-6-yl)thiazol-5-yl]ethylammonium CAS Name: 2-[2-amino-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-thiazolyl]ethylammonium IUPAC Name: 2-[2-amino-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-5-yl]ethylazanium Traditional Name: 2-[2-amino-4-(2,3-dihydro-1,4-benzodioxin-6-yl)thiazol-5-yl]ethylammonium Formula: C13H16N3O2S+ MolecularWeight: 278.35004

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=C(SC(=N3)N)CC[NH3+]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=C(SC(=N3)N)CC[NH3+]

InChI

InChI=1S/C13H15N3O2S/c14-4-3-11-12(16-13(15)19-11)8-1-2-9-10(7-8)18-6-5-17-9/h1-2,7H,3-6,14H2,(H2,15,16)/p+1