2-[4-[[3-(furan-2-yl)-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-[[3-(furan-2-yl)-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]-N-propan-2-yl-ethanamide Openeye Name: 2-[4-[[3-(2-furyl)-4-methyl-5-thioxo-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]-N-isopropyl-acetamide CAS Name: 2-[4-[[3-(2-furanyl)-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-1-piperazinyl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-[[3-(furan-2-yl)-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]-N-propan-2-ylacetamide Traditional Name: 2-[4-[[3-(2-furyl)-4-methyl-5-thioxo-1,2,4-triazol-1-yl]methyl]piperazino]-N-isopropyl-acetamide Formula: C17H26N6O2S MolecularWeight: 378.49234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN1CCN(CC1)CN2C(=S)N(C(=N2)C3=CC=CO3)C

Isomeric SMILES

CC(C)NC(=O)CN1CCN(CC1)CN2C(=S)N(C(=N2)C3=CC=CO3)C

InChI

InChI=1S/C17H26N6O2S/c1-13(2)18-15(24)11-21-6-8-22(9-7-21)12-23-17(26)20(3)16(19-23)14-5-4-10-25-14/h4-5,10,13H,6-9,11-12H2,1-3H3,(H,18,24)