(2S)-N-(4-butan-2-ylphenyl)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-(4-butan-2-ylphenyl)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-1-(3,5-dimethylisoxazol-4-yl)sulfonyl-N-(4-sec-butylphenyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-(4-butan-2-ylphenyl)-1-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-(4-butan-2-ylphenyl)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-1-(3,5-dimethylisoxazol-4-yl)sulfonyl-N-(4-sec-butylphenyl)pyrrolidine-2-carboxamide Formula: C20H27N3O4S MolecularWeight: 405.51108

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)C2CCCN2S(=O)(=O)C3=C(ON=C3C)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=O)[C@@H]2CCCN2S(=O)(=O)C3=C(ON=C3C)C

InChI

InChI=1S/C20H27N3O4S/c1-5-13(2)16-8-10-17(11-9-16)21-20(24)18-7-6-12-23(18)28(25,26)19-14(3)22-27-15(19)4/h8-11,13,18H,5-7,12H2,1-4H3,(H,21,24)/t13?,18-/m0/s1