N-(oxan-3-ylmethyl)-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-(oxan-3-ylmethyl)-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-(tetrahydropyran-3-ylmethyl)-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-(3-oxanylmethyl)-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-(oxan-3-ylmethyl)-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-(tetrahydropyran-3-ylmethyl)-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C14H18N4O2S2 MolecularWeight: 338.44832

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(COC1)CNC(=O)CN2C(=NNC2=S)C3=CC=CS3

Isomeric SMILES

C1CC(COC1)CNC(=O)CN2C(=NNC2=S)C3=CC=CS3

InChI

InChI=1S/C14H18N4O2S2/c19-12(15-7-10-3-1-5-20-9-10)8-18-13(16-17-14(18)21)11-4-2-6-22-11/h2,4,6,10H,1,3,5,7-9H2,(H,15,19)(H,17,21)