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

Systemtic Name: N-[2-(1-adamantyl)ethyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridine-3-carboxamide Openeye Name: N-[2-(1-adamantyl)ethyl]-2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]pyridine-3-carboxamide CAS Name: N-[2-(1-adamantyl)ethyl]-2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-3-pyridinecarboxamide IUPAC Name: N-[2-(1-adamantyl)ethyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridine-3-carboxamide Traditional Name: N-[2-(1-adamantyl)ethyl]-2-[(3,5-dimethylisoxazol-4-yl)methylthio]nicotinamide Formula: C24H31N3O2S MolecularWeight: 425.58684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NCCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NCCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H31N3O2S/c1-15-21(16(2)29-27-15)14-30-23-20(4-3-6-26-23)22(28)25-7-5-24-11-17-8-18(12-24)10-19(9-17)13-24/h3-4,6,17-19H,5,7-14H2,1-2H3,(H,25,28)