2-methyl-1-[4-[2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanoyl]piperazin-1-yl]propan-1-one

Systemtic Name: 2-methyl-1-[4-[2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanoyl]piperazin-1-yl]propan-1-one Openeye Name: 2-methyl-1-[4-[2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetyl]piperazin-1-yl]propan-1-one CAS Name: 2-methyl-1-[4-[1-oxo-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-methyl-1-[4-[2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetyl]piperazin-1-yl]propan-1-one Traditional Name: 2-methyl-1-[4-[2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetyl]piperazino]propan-1-one Formula: C16H21N5O2S2 MolecularWeight: 379.50024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C(=O)CN2C(=NNC2=S)C3=CC=CS3

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C(=O)CN2C(=NNC2=S)C3=CC=CS3

InChI

InChI=1S/C16H21N5O2S2/c1-11(2)15(23)20-7-5-19(6-8-20)13(22)10-21-14(17-18-16(21)24)12-4-3-9-25-12/h3-4,9,11H,5-8,10H2,1-2H3,(H,18,24)