N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-[4-methoxy-3-(3-pyridylmethoxy)phenyl]-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide CAS Name: N-[4-methoxy-3-(3-pyridinylmethoxy)phenyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-[4-methoxy-3-(3-pyridylmethoxy)phenyl]-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide Formula: C20H23N5O3S MolecularWeight: 413.49332

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)NC2=CC(=C(C=C2)OC)OCC3=CN=CC=C3

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)NC2=CC(=C(C=C2)OC)OCC3=CN=CC=C3

InChI

InChI=1S/C20H23N5O3S/c1-3-5-18-23-24-20(29)25(18)12-19(26)22-15-7-8-16(27-2)17(10-15)28-13-14-6-4-9-21-11-14/h4,6-11H,3,5,12-13H2,1-2H3,(H,22,26)(H,24,29)