N-(1-adamantylmethyl)-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-(1-adamantylmethyl)-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-(1-adamantylmethyl)-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-(1-adamantylmethyl)-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-(1-adamantylmethyl)-2-(methylthio)nicotinamide Formula: C18H24N2OS MolecularWeight: 316.46096

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C18H24N2OS/c1-22-17-15(3-2-4-19-17)16(21)20-11-18-8-12-5-13(9-18)7-14(6-12)10-18/h2-4,12-14H,5-11H2,1H3,(H,20,21)