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

Systemtic Name: N-tert-butyl-2-[4-[[4-(furan-2-ylmethyl)-3-propan-2-yl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[[4-(2-furylmethyl)-3-isopropyl-5-thioxo-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[[4-(2-furanylmethyl)-3-propan-2-yl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-1-piperazinyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[[4-(furan-2-ylmethyl)-3-propan-2-yl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[[4-(2-furfuryl)-3-isopropyl-5-thioxo-1,2,4-triazol-1-yl]methyl]piperazino]acetamide Formula: C21H34N6O2S MolecularWeight: 434.59866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C(=S)N1CC2=CC=CO2)CN3CCN(CC3)CC(=O)NC(C)(C)C

Isomeric SMILES

CC(C)C1=NN(C(=S)N1CC2=CC=CO2)CN3CCN(CC3)CC(=O)NC(C)(C)C

InChI

InChI=1S/C21H34N6O2S/c1-16(2)19-23-27(20(30)26(19)13-17-7-6-12-29-17)15-25-10-8-24(9-11-25)14-18(28)22-21(3,4)5/h6-7,12,16H,8-11,13-15H2,1-5H3,(H,22,28)