(2S)-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-propyl-propanamide

Systemtic Name: (2S)-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-propyl-propanamide Openeye Name: (2S)-2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-propanamide CAS Name: (2S)-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-N-propylpropanamide IUPAC Name: (2S)-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-propylpropanamide Traditional Name: (2S)-2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-N-propyl-propionamide Formula: C15H21N5OS MolecularWeight: 319.42514

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)SC1=NN=C(N1CC)C2=CC=NC=C2

Isomeric SMILES

CCCNC(=O)[C@H](C)SC1=NN=C(N1CC)C2=CC=NC=C2

InChI

InChI=1S/C15H21N5OS/c1-4-8-17-14(21)11(3)22-15-19-18-13(20(15)5-2)12-6-9-16-10-7-12/h6-7,9-11H,4-5,8H2,1-3H3,(H,17,21)/t11-/m0/s1