N-(1-adamantyl)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidine-3-carboxamide

Systemtic Name: N-(1-adamantyl)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidine-3-carboxamide Openeye Name: N-(1-adamantyl)-1-(3,5-dimethylisoxazol-4-yl)sulfonyl-piperidine-3-carboxamide CAS Name: N-(1-adamantyl)-1-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-(1-adamantyl)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidine-3-carboxamide Traditional Name: N-(1-adamantyl)-1-(3,5-dimethylisoxazol-4-yl)sulfonyl-nipecotamide Formula: C21H31N3O4S MolecularWeight: 421.55354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCC(C2)C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCC(C2)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H31N3O4S/c1-13-19(14(2)28-23-13)29(26,27)24-5-3-4-18(12-24)20(25)22-21-9-15-6-16(10-21)8-17(7-15)11-21/h15-18H,3-12H2,1-2H3,(H,22,25)