2-(phenylmethylsulfanyl)-N-[6-(1,2,4-triazol-1-yl)pyridin-3-yl]propanamide

Systemtic Name: 2-(phenylmethylsulfanyl)-N-[6-(1,2,4-triazol-1-yl)pyridin-3-yl]propanamide Openeye Name: 2-benzylsulfanyl-N-[6-(1,2,4-triazol-1-yl)-3-pyridyl]propanamide CAS Name: 2-(phenylmethylthio)-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]propanamide IUPAC Name: 2-benzylsulfanyl-N-[6-(1,2,4-triazol-1-yl)pyridin-3-yl]propanamide Traditional Name: 2-(benzylthio)-N-[6-(1,2,4-triazol-1-yl)-3-pyridyl]propionamide Formula: C17H17N5OS MolecularWeight: 339.41478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CN=C(C=C1)N2C=NC=N2)SCC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CN=C(C=C1)N2C=NC=N2)SCC3=CC=CC=C3

InChI

InChI=1S/C17H17N5OS/c1-13(24-10-14-5-3-2-4-6-14)17(23)21-15-7-8-16(19-9-15)22-12-18-11-20-22/h2-9,11-13H,10H2,1H3,(H,21,23)