N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide Formula: C12H11BrN4O3S MolecularWeight: 371.20974

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Br)NC(=O)CSC3=NC=NN3

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Br)NC(=O)CSC3=NC=NN3

InChI

InChI=1S/C12H11BrN4O3S/c13-7-3-9-10(20-2-1-19-9)4-8(7)16-11(18)5-21-12-14-6-15-17-12/h3-4,6H,1-2,5H2,(H,16,18)(H,14,15,17)