6-[3-(1-adamantylmethylcarbamoyl)-4-chloranyl-phenyl]-N-methylsulfonyl-pyridine-2-carboxamide

Systemtic Name: 6-[3-(1-adamantylmethylcarbamoyl)-4-chloranyl-phenyl]-N-methylsulfonyl-pyridine-2-carboxamide Openeye Name: 6-[3-(1-adamantylmethylcarbamoyl)-4-chloro-phenyl]-N-methylsulfonyl-pyridine-2-carboxamide CAS Name: 6-[3-[(1-adamantylmethylamino)-oxomethyl]-4-chlorophenyl]-N-methylsulfonyl-2-pyridinecarboxamide IUPAC Name: 6-[3-(1-adamantylmethylcarbamoyl)-4-chlorophenyl]-N-methylsulfonylpyridine-2-carboxamide Traditional Name: 6-[3-(1-adamantylmethylcarbamoyl)-4-chloro-phenyl]-N-mesyl-picolinamide Formula: C25H28ClN3O4S MolecularWeight: 502.02552

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC(=O)C1=CC=CC(=N1)C2=CC(=C(C=C2)Cl)C(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CS(=O)(=O)NC(=O)C1=CC=CC(=N1)C2=CC(=C(C=C2)Cl)C(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H28ClN3O4S/c1-34(32,33)29-24(31)22-4-2-3-21(28-22)18-5-6-20(26)19(10-18)23(30)27-14-25-11-15-7-16(12-25)9-17(8-15)13-25/h2-6,10,15-17H,7-9,11-14H2,1H3,(H,27,30)(H,29,31)