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

Systemtic Name: N-(4-ethoxyphenyl)-2-[[4-methyl-5-(1-methyl-2-oxidanylidene-pyridin-3-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(4-ethoxyphenyl)-2-[[4-methyl-5-(1-methyl-2-oxo-3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(4-ethoxyphenyl)-2-[[4-methyl-5-(1-methyl-2-oxo-3-pyridinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(4-ethoxyphenyl)-2-[[4-methyl-5-(1-methyl-2-oxopyridin-3-yl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[5-(2-keto-1-methyl-3-pyridyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-p-phenetyl-acetamide Formula: C19H21N5O3S MolecularWeight: 399.46674

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C)C3=CC=CN(C3=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C)C3=CC=CN(C3=O)C

InChI

InChI=1S/C19H21N5O3S/c1-4-27-14-9-7-13(8-10-14)20-16(25)12-28-19-22-21-17(24(19)3)15-6-5-11-23(2)18(15)26/h5-11H,4,12H2,1-3H3,(H,20,25)