1-[[4-cyclopropyl-3-(2-fluorophenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperidine-4-carboxamide

Systemtic Name: 1-[[4-cyclopropyl-3-(2-fluorophenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperidine-4-carboxamide Openeye Name: 1-[[4-cyclopropyl-3-(2-fluorophenyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]piperidine-4-carboxamide CAS Name: 1-[[4-cyclopropyl-3-(2-fluorophenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-[[4-cyclopropyl-3-(2-fluorophenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperidine-4-carboxamide Traditional Name: 1-[[4-cyclopropyl-3-(2-fluorophenyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]isonipecotamide Formula: C18H22FN5OS MolecularWeight: 375.463583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN(C2=S)CN3CCC(CC3)C(=O)N)C4=CC=CC=C4F

Isomeric SMILES

C1CC1N2C(=NN(C2=S)CN3CCC(CC3)C(=O)N)C4=CC=CC=C4F

InChI

InChI=1S/C18H22FN5OS/c19-15-4-2-1-3-14(15)17-21-23(18(26)24(17)13-5-6-13)11-22-9-7-12(8-10-22)16(20)25/h1-4,12-13H,5-11H2,(H2,20,25)