N-butyl-2-[4-[2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanoyl]piperazin-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-[2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanoyl]piperazin-1-yl]ethanamide Openeye Name: N-butyl-2-[4-[2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetyl]piperazin-1-yl]acetamide CAS Name: N-butyl-2-[4-[1-oxo-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethyl]-1-piperazinyl]acetamide IUPAC Name: N-butyl-2-[4-[2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetyl]piperazin-1-yl]acetamide Traditional Name: N-butyl-2-[4-[2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetyl]piperazino]acetamide Formula: C18H26N6O2S2 MolecularWeight: 422.56804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1CCN(CC1)C(=O)CN2C(=NNC2=S)C3=CC=CS3

Isomeric SMILES

CCCCNC(=O)CN1CCN(CC1)C(=O)CN2C(=NNC2=S)C3=CC=CS3

InChI

InChI=1S/C18H26N6O2S2/c1-2-3-6-19-15(25)12-22-7-9-23(10-8-22)16(26)13-24-17(20-21-18(24)27)14-5-4-11-28-14/h4-5,11H,2-3,6-10,12-13H2,1H3,(H,19,25)(H,21,27)