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

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[(4-piperidin-1-ylcarbonylphenyl)methyl]pyridine-3-carboxamide Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]pyridine-3-carboxamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-N-[[4-[oxo(1-piperidinyl)methyl]phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]pyridine-3-carboxamide Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-N-[4-(piperidine-1-carbonyl)benzyl]nicotinamide Formula: C25H28N4O3S MolecularWeight: 464.57982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NCC3=CC=C(C=C3)C(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NCC3=CC=C(C=C3)C(=O)N4CCCCC4

InChI

InChI=1S/C25H28N4O3S/c1-17-22(18(2)32-28-17)16-33-24-21(7-6-12-26-24)23(30)27-15-19-8-10-20(11-9-19)25(31)29-13-4-3-5-14-29/h6-12H,3-5,13-16H2,1-2H3,(H,27,30)