N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethanamide

Systemtic Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethanamide Openeye Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)acetamide CAS Name: N-(5-tert-butyl-2-phenyl-3-pyrazolyl)-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylthio)acetamide IUPAC Name: N-(5-tert-butyl-2-phenylpyrazol-3-yl)-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)acetamide Traditional Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylthio)acetamide Formula: C21H22N6OS MolecularWeight: 406.50398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)CSC2=NN=C3N2C=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)CSC2=NN=C3N2C=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N6OS/c1-21(2,3)16-13-18(27(25-16)15-9-5-4-6-10-15)22-19(28)14-29-20-24-23-17-11-7-8-12-26(17)20/h4-13H,14H2,1-3H3,(H,22,28)