(4-tert-butylphenyl)methyl 3-morpholin-4-ylsulfonylthiophene-2-carboxylate

Systemtic Name: (4-tert-butylphenyl)methyl 3-morpholin-4-ylsulfonylthiophene-2-carboxylate Openeye Name: (4-tert-butylphenyl)methyl 3-morpholinosulfonylthiophene-2-carboxylate CAS Name: 3-(4-morpholinylsulfonyl)-2-thiophenecarboxylic acid (4-tert-butylphenyl)methyl ester IUPAC Name: (4-tert-butylphenyl)methyl 3-morpholin-4-ylsulfonylthiophene-2-carboxylate Traditional Name: 3-morpholinosulfonylthiophene-2-carboxylic acid (4-tert-butylbenzyl) ester Formula: C20H25NO5S2 MolecularWeight: 423.5462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC(=O)C2=C(C=CS2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC(=O)C2=C(C=CS2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H25NO5S2/c1-20(2,3)16-6-4-15(5-7-16)14-26-19(22)18-17(8-13-27-18)28(23,24)21-9-11-25-12-10-21/h4-8,13H,9-12,14H2,1-3H3