2-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2R)-2-ethylhexyl]ethanamide

Systemtic Name: 2-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2R)-2-ethylhexyl]ethanamide Openeye Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2R)-2-ethylhexyl]acetamide CAS Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-[(2R)-2-ethylhexyl]acetamide IUPAC Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2R)-2-ethylhexyl]acetamide Traditional Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-[(2R)-2-ethylhexyl]acetamide Formula: C15H27N5OS MolecularWeight: 325.47278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)CSC1=NN=C(N1N)C2CC2

Isomeric SMILES

CCCC[C@@H](CC)CNC(=O)CSC1=NN=C(N1N)C2CC2

InChI

InChI=1S/C15H27N5OS/c1-3-5-6-11(4-2)9-17-13(21)10-22-15-19-18-14(20(15)16)12-7-8-12/h11-12H,3-10,16H2,1-2H3,(H,17,21)/t11-/m1/s1