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

Systemtic Name: 2-[[4-cyclopropyl-3-(2-fluorophenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methyl-amino]-N-propan-2-yl-ethanamide Openeye Name: 2-[[4-cyclopropyl-3-(2-fluorophenyl)-5-thioxo-1,2,4-triazol-1-yl]methyl-methyl-amino]-N-isopropyl-acetamide CAS Name: 2-[[4-cyclopropyl-3-(2-fluorophenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methylamino]-N-propan-2-ylacetamide IUPAC Name: 2-[[4-cyclopropyl-3-(2-fluorophenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methylamino]-N-propan-2-ylacetamide Traditional Name: 2-[[4-cyclopropyl-3-(2-fluorophenyl)-5-thioxo-1,2,4-triazol-1-yl]methyl-methyl-amino]-N-isopropyl-acetamide Formula: C18H24FN5OS MolecularWeight: 377.479463

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24FN5OS/c1-12(2)20-16(25)10-22(3)11-23-18(26)24(13-8-9-13)17(21-23)14-6-4-5-7-15(14)19/h4-7,12-13H,8-11H2,1-3H3,(H,20,25)