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

Systemtic Name: 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(2-phenylbutyl)piperidine-3-carboxamide Openeye Name: 1-(3,5-dimethylisoxazol-4-yl)sulfonyl-N-(2-phenylbutyl)piperidine-3-carboxamide CAS Name: 1-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-N-(2-phenylbutyl)-3-piperidinecarboxamide IUPAC Name: 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(2-phenylbutyl)piperidine-3-carboxamide Traditional Name: 1-(3,5-dimethylisoxazol-4-yl)sulfonyl-N-(2-phenylbutyl)nipecotamide Formula: C21H29N3O4S MolecularWeight: 419.53766

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C1CCCN(C1)S(=O)(=O)C2=C(ON=C2C)C)C3=CC=CC=C3

Isomeric SMILES

CCC(CNC(=O)C1CCCN(C1)S(=O)(=O)C2=C(ON=C2C)C)C3=CC=CC=C3

InChI

InChI=1S/C21H29N3O4S/c1-4-17(18-9-6-5-7-10-18)13-22-21(25)19-11-8-12-24(14-19)29(26,27)20-15(2)23-28-16(20)3/h5-7,9-10,17,19H,4,8,11-14H2,1-3H3,(H,22,25)