2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]pyridine-3-carboxamide

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]pyridine-3-carboxamide Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-N-[(6-pyrazol-1-yl-3-pyridyl)methyl]pyridine-3-carboxamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-N-[[6-(1-pyrazolyl)-3-pyridinyl]methyl]-3-pyridinecarboxamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]pyridine-3-carboxamide Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-N-[(6-pyrazol-1-yl-3-pyridyl)methyl]nicotinamide Formula: C21H20N6O2S MolecularWeight: 420.4875

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NCC3=CN=C(C=C3)N4C=CC=N4

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NCC3=CN=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C21H20N6O2S/c1-14-18(15(2)29-26-14)13-30-21-17(5-3-8-22-21)20(28)24-12-16-6-7-19(23-11-16)27-10-4-9-25-27/h3-11H,12-13H2,1-2H3,(H,24,28)