N-tert-butyl-2-[[4-cyclopropyl-3-(2-fluorophenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methyl-amino]ethanamide

Systemtic Name: N-tert-butyl-2-[[4-cyclopropyl-3-(2-fluorophenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methyl-amino]ethanamide Openeye Name: N-tert-butyl-2-[[4-cyclopropyl-3-(2-fluorophenyl)-5-thioxo-1,2,4-triazol-1-yl]methyl-methyl-amino]acetamide CAS Name: N-tert-butyl-2-[[4-cyclopropyl-3-(2-fluorophenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methylamino]acetamide IUPAC Name: N-tert-butyl-2-[[4-cyclopropyl-3-(2-fluorophenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methylamino]acetamide Traditional Name: N-tert-butyl-2-[[4-cyclopropyl-3-(2-fluorophenyl)-5-thioxo-1,2,4-triazol-1-yl]methyl-methyl-amino]acetamide Formula: C19H26FN5OS MolecularWeight: 391.506043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN(C)CN1C(=S)N(C(=N1)C2=CC=CC=C2F)C3CC3

Isomeric SMILES

CC(C)(C)NC(=O)CN(C)CN1C(=S)N(C(=N1)C2=CC=CC=C2F)C3CC3

InChI

InChI=1S/C19H26FN5OS/c1-19(2,3)21-16(26)11-23(4)12-24-18(27)25(13-9-10-13)17(22-24)14-7-5-6-8-15(14)20/h5-8,13H,9-12H2,1-4H3,(H,21,26)