2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[1-(4-imidazol-1-ylphenyl)ethyl]pyridine-3-carboxamide

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[1-(4-imidazol-1-ylphenyl)ethyl]pyridine-3-carboxamide Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-N-[1-(4-imidazol-1-ylphenyl)ethyl]pyridine-3-carboxamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-N-[1-[4-(1-imidazolyl)phenyl]ethyl]-3-pyridinecarboxamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[1-(4-imidazol-1-ylphenyl)ethyl]pyridine-3-carboxamide Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-N-[1-(4-imidazol-1-ylphenyl)ethyl]nicotinamide Formula: C23H23N5O2S MolecularWeight: 433.52602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NC(C)C3=CC=C(C=C3)N4C=CN=C4

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NC(C)C3=CC=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C23H23N5O2S/c1-15(18-6-8-19(9-7-18)28-12-11-24-14-28)26-22(29)20-5-4-10-25-23(20)31-13-21-16(2)27-30-17(21)3/h4-12,14-15H,13H2,1-3H3,(H,26,29)