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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C21H29N3O4S/c1-14-19(15(2)28-23-14)29(26,27)24-12-6-7-16(13-24)20(25)22-18-10-8-17(9-11-18)21(3,4)5/h8-11,16H,6-7,12-13H2,1-5H3,(H,22,25)