3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylsulfanyl)-1H-1,2,4-triazol-5-amine

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

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CSC3=NNC(=N3)N

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CSC3=NNC(=N3)N

InChI

InChI=1S/C11H12N4O2S/c12-10-13-11(15-14-10)18-6-7-1-2-8-9(5-7)17-4-3-16-8/h1-2,5H,3-4,6H2,(H3,12,13,14,15)