N-tert-butyl-2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-tert-butyl-2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-tert-butyl-2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-tert-butyl-2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-tert-butyl-2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-tert-butyl-2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]thio]propionamide Formula: C16H28N4OS MolecularWeight: 324.48472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)SC1=NNC(=N1)CCC2CCCC2

Isomeric SMILES

CC(C(=O)NC(C)(C)C)SC1=NNC(=N1)CCC2CCCC2

InChI

InChI=1S/C16H28N4OS/c1-11(14(21)18-16(2,3)4)22-15-17-13(19-20-15)10-9-12-7-5-6-8-12/h11-12H,5-10H2,1-4H3,(H,18,21)(H,17,19,20)