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

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[1-(2-methylpropanoyl)piperidin-4-yl]pyridine-3-carboxamide Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-N-[1-(2-methylpropanoyl)-4-piperidyl]pyridine-3-carboxamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-N-[1-(2-methyl-1-oxopropyl)-4-piperidinyl]-3-pyridinecarboxamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[1-(2-methylpropanoyl)piperidin-4-yl]pyridine-3-carboxamide Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-N-(1-isobutyryl-4-piperidyl)nicotinamide Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NC3CCN(CC3)C(=O)C(C)C

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NC3CCN(CC3)C(=O)C(C)C

InChI

InChI=1S/C21H28N4O3S/c1-13(2)21(27)25-10-7-16(8-11-25)23-19(26)17-6-5-9-22-20(17)29-12-18-14(3)24-28-15(18)4/h5-6,9,13,16H,7-8,10-12H2,1-4H3,(H,23,26)