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

Systemtic Name: 2-[(2-ethanoyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[[2-acetyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(p-tolyl)acetamide CAS Name: 2-[(2-acetyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[(2-acetyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methylphenyl)acetamide Traditional Name: 2-[[2-acetyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-N-(p-tolyl)acetamide Formula: C18H17N5O2S MolecularWeight: 367.42488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC2=NC(=NN2C(=O)C)C3=CC=NC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC2=NC(=NN2C(=O)C)C3=CC=NC=C3

InChI

InChI=1S/C18H17N5O2S/c1-12-3-5-15(6-4-12)20-16(25)11-26-18-21-17(22-23(18)13(2)24)14-7-9-19-10-8-14/h3-10H,11H2,1-2H3,(H,20,25)