N-[4-[2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]phenyl]ethanamide

Systemtic Name: N-[4-[2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]phenyl]ethanamide Openeye Name: N-[4-[2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propanoyl]phenyl]acetamide CAS Name: N-[4-[2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-1-oxopropyl]phenyl]acetamide IUPAC Name: N-[4-[2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]phenyl]acetamide Traditional Name: N-[4-[2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]propanoyl]phenyl]acetamide Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C(=O)C2=CC=C(C=C2)NC(=O)C)C3=CC=NC=C3

Isomeric SMILES

CCN1C(=NN=C1SC(C)C(=O)C2=CC=C(C=C2)NC(=O)C)C3=CC=NC=C3

InChI

InChI=1S/C20H21N5O2S/c1-4-25-19(16-9-11-21-12-10-16)23-24-20(25)28-13(2)18(27)15-5-7-17(8-6-15)22-14(3)26/h5-13H,4H2,1-3H3,(H,22,26)