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

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[(1-phenylpyrazol-4-yl)methyl]pyridine-3-carboxamide Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-N-[(1-phenylpyrazol-4-yl)methyl]pyridine-3-carboxamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-N-[(1-phenyl-4-pyrazolyl)methyl]-3-pyridinecarboxamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[(1-phenylpyrazol-4-yl)methyl]pyridine-3-carboxamide Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-N-[(1-phenylpyrazol-4-yl)methyl]nicotinamide Formula: C22H21N5O2S MolecularWeight: 419.49944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H21N5O2S/c1-15-20(16(2)29-26-15)14-30-22-19(9-6-10-23-22)21(28)24-11-17-12-25-27(13-17)18-7-4-3-5-8-18/h3-10,12-13H,11,14H2,1-2H3,(H,24,28)