N-tert-butyl-2-[4-[(4-ethyl-5-sulfanylidene-3-thiophen-2-yl-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[(4-ethyl-5-sulfanylidene-3-thiophen-2-yl-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[[4-ethyl-3-(2-thienyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[(4-ethyl-5-sulfanylidene-3-thiophen-2-yl-1,2,4-triazol-1-yl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[(4-ethyl-5-sulfanylidene-3-thiophen-2-yl-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[[4-ethyl-3-(2-thienyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]piperazino]acetamide Formula: C19H30N6OS2 MolecularWeight: 422.6111

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)CN2CCN(CC2)CC(=O)NC(C)(C)C)C3=CC=CS3

Isomeric SMILES

CCN1C(=NN(C1=S)CN2CCN(CC2)CC(=O)NC(C)(C)C)C3=CC=CS3

InChI

InChI=1S/C19H30N6OS2/c1-5-24-17(15-7-6-12-28-15)21-25(18(24)27)14-23-10-8-22(9-11-23)13-16(26)20-19(2,3)4/h6-7,12H,5,8-11,13-14H2,1-4H3,(H,20,26)