2-[[4-ethyl-5-(1-methyl-2-oxidanylidene-pyridin-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-ethylphenyl)ethanamide

Systemtic Name: 2-[[4-ethyl-5-(1-methyl-2-oxidanylidene-pyridin-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-ethylphenyl)ethanamide Openeye Name: 2-[[4-ethyl-5-(1-methyl-2-oxo-3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-ethylphenyl)acetamide CAS Name: 2-[[4-ethyl-5-(1-methyl-2-oxo-3-pyridinyl)-1,2,4-triazol-3-yl]thio]-N-(4-ethylphenyl)acetamide IUPAC Name: 2-[[4-ethyl-5-(1-methyl-2-oxopyridin-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-ethylphenyl)acetamide Traditional Name: 2-[[4-ethyl-5-(2-keto-1-methyl-3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-(4-ethylphenyl)acetamide Formula: C20H23N5O2S MolecularWeight: 397.49392

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CC)C3=CC=CN(C3=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CC)C3=CC=CN(C3=O)C

InChI

InChI=1S/C20H23N5O2S/c1-4-14-8-10-15(11-9-14)21-17(26)13-28-20-23-22-18(25(20)5-2)16-7-6-12-24(3)19(16)27/h6-12H,4-5,13H2,1-3H3,(H,21,26)