8-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-4H-1,3-benzodioxin-6-amine

Systemtic Name: 8-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-4H-1,3-benzodioxin-6-amine Openeye Name: 8-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-4H-1,3-benzodioxin-6-amine CAS Name: 8-[(1H-1,2,4-triazol-5-ylthio)methyl]-4H-1,3-benzodioxin-6-amine IUPAC Name: 8-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-4H-1,3-benzodioxin-6-amine Traditional Name: [8-[(1H-1,2,4-triazol-5-ylthio)methyl]-4H-1,3-benzodioxin-6-yl]amine Formula: C11H12N4O2S MolecularWeight: 264.30358

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CSC3=NC=NN3)N

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CSC3=NC=NN3)N

InChI

InChI=1S/C11H12N4O2S/c12-9-1-7-3-16-6-17-10(7)8(2-9)4-18-11-13-5-14-15-11/h1-2,5H,3-4,6,12H2,(H,13,14,15)