3-(4-tert-butyl-3-methoxy-phenyl)carbonyl-4-(pyrazol-1-ylmethyl)-2-thiophen-2-yl-1,3-oxazolidine-4-carboxylic acid

Systemtic Name: 3-(4-tert-butyl-3-methoxy-phenyl)carbonyl-4-(pyrazol-1-ylmethyl)-2-thiophen-2-yl-1,3-oxazolidine-4-carboxylic acid Openeye Name: 3-(4-tert-butyl-3-methoxy-benzoyl)-4-(pyrazol-1-ylmethyl)-2-(2-thienyl)oxazolidine-4-carboxylic acid CAS Name: 3-[(4-tert-butyl-3-methoxyphenyl)-oxomethyl]-4-(1-pyrazolylmethyl)-2-thiophen-2-yl-4-oxazolidinecarboxylic acid IUPAC Name: 3-(4-tert-butyl-3-methoxybenzoyl)-4-(pyrazol-1-ylmethyl)-2-thiophen-2-yl-1,3-oxazolidine-4-carboxylic acid Traditional Name: 3-(4-tert-butyl-3-methoxy-benzoyl)-4-(pyrazol-1-ylmethyl)-2-(2-thienyl)oxazolidine-4-carboxylic acid Formula: C24H27N3O5S MolecularWeight: 469.55328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)C(=O)N2C(OCC2(CN3C=CC=N3)C(=O)O)C4=CC=CS4)OC

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)C(=O)N2C(OCC2(CN3C=CC=N3)C(=O)O)C4=CC=CS4)OC

InChI

InChI=1S/C24H27N3O5S/c1-23(2,3)17-9-8-16(13-18(17)31-4)20(28)27-21(19-7-5-12-33-19)32-15-24(27,22(29)30)14-26-11-6-10-25-26/h5-13,21H,14-15H2,1-4H3,(H,29,30)