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

Systemtic Name: 3-[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-N-pyridin-2-yl-propanamide Openeye Name: 3-[(4-allyl-5-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-pyridyl)propanamide CAS Name: 3-[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]-N-(2-pyridinyl)propanamide IUPAC Name: 3-[(5-ethyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-N-pyridin-2-ylpropanamide Traditional Name: 3-[(4-allyl-5-ethyl-1,2,4-triazol-3-yl)thio]-N-(2-pyridyl)propionamide Formula: C15H19N5OS MolecularWeight: 317.40926

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1CC=C)SCCC(=O)NC2=CC=CC=N2

Isomeric SMILES

CCC1=NN=C(N1CC=C)SCCC(=O)NC2=CC=CC=N2

InChI

InChI=1S/C15H19N5OS/c1-3-10-20-13(4-2)18-19-15(20)22-11-8-14(21)17-12-7-5-6-9-16-12/h3,5-7,9H,1,4,8,10-11H2,2H3,(H,16,17,21)