2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(6-imidazol-1-ylpyridin-3-yl)benzamide

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(6-imidazol-1-ylpyridin-3-yl)benzamide Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-N-(6-imidazol-1-yl-3-pyridyl)benzamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-N-[6-(1-imidazolyl)-3-pyridinyl]benzamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(6-imidazol-1-ylpyridin-3-yl)benzamide Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-N-(6-imidazol-1-yl-3-pyridyl)benzamide Formula: C21H19N5O2S MolecularWeight: 405.47286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=CC=CC=C2C(=O)NC3=CN=C(C=C3)N4C=CN=C4

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=CC=CC=C2C(=O)NC3=CN=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C21H19N5O2S/c1-14-18(15(2)28-25-14)12-29-19-6-4-3-5-17(19)21(27)24-16-7-8-20(23-11-16)26-10-9-22-13-26/h3-11,13H,12H2,1-2H3,(H,24,27)