N-(6-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-(6-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C16H13ClN4O3S2 MolecularWeight: 408.88242

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Cl)NC(=O)CN3C(=NNC3=S)C4=CC=CS4

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Cl)NC(=O)CN3C(=NNC3=S)C4=CC=CS4

InChI

InChI=1S/C16H13ClN4O3S2/c17-9-6-11-12(24-4-3-23-11)7-10(9)18-14(22)8-21-15(19-20-16(21)25)13-2-1-5-26-13/h1-2,5-7H,3-4,8H2,(H,18,22)(H,20,25)