2-[[4-(3-methoxypropyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-pyridin-3-yl-ethanamide

Systemtic Name: 2-[[4-(3-methoxypropyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-pyridin-3-yl-ethanamide Openeye Name: 2-[[4-(3-methoxypropyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-pyridyl)acetamide CAS Name: 2-[[4-(3-methoxypropyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]thio]-N-(3-pyridinyl)acetamide IUPAC Name: 2-[[4-(3-methoxypropyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-pyridin-3-ylacetamide Traditional Name: 2-[[4-(3-methoxypropyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]thio]-N-(3-pyridyl)acetamide Formula: C20H23N5O3S MolecularWeight: 413.49332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=NN=C1SCC(=O)NC2=CN=CC=C2)COC3=CC=CC=C3

Isomeric SMILES

COCCCN1C(=NN=C1SCC(=O)NC2=CN=CC=C2)COC3=CC=CC=C3

InChI

InChI=1S/C20H23N5O3S/c1-27-12-6-11-25-18(14-28-17-8-3-2-4-9-17)23-24-20(25)29-15-19(26)22-16-7-5-10-21-13-16/h2-5,7-10,13H,6,11-12,14-15H2,1H3,(H,22,26)