N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[[4-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[[4-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C17H15BrN4O3S2 MolecularWeight: 467.36

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)NC2=CC3=C(C=C2Br)OCCO3)C4=CC=CS4

Isomeric SMILES

CN1C(=NN=C1SCC(=O)NC2=CC3=C(C=C2Br)OCCO3)C4=CC=CS4

InChI

InChI=1S/C17H15BrN4O3S2/c1-22-16(14-3-2-6-26-14)20-21-17(22)27-9-15(23)19-11-8-13-12(7-10(11)18)24-4-5-25-13/h2-3,6-8H,4-5,9H2,1H3,(H,19,23)