(2-phenyl-1,3-thiazol-4-yl)methyl 4-[(5-tert-butyl-2-methyl-phenyl)sulfonylamino]benzoate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 4-[(5-tert-butyl-2-methyl-phenyl)sulfonylamino]benzoate Openeye Name: (2-phenylthiazol-4-yl)methyl 4-[(5-tert-butyl-2-methyl-phenyl)sulfonylamino]benzoate CAS Name: 4-[(5-tert-butyl-2-methylphenyl)sulfonylamino]benzoic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 4-[(5-tert-butyl-2-methylphenyl)sulfonylamino]benzoate Traditional Name: 4-[(5-tert-butyl-2-methyl-phenyl)sulfonylamino]benzoic acid (2-phenylthiazol-4-yl)methyl ester Formula: C28H28N2O4S2 MolecularWeight: 520.66292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)NC2=CC=C(C=C2)C(=O)OCC3=CSC(=N3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)NC2=CC=C(C=C2)C(=O)OCC3=CSC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C28H28N2O4S2/c1-19-10-13-22(28(2,3)4)16-25(19)36(32,33)30-23-14-11-21(12-15-23)27(31)34-17-24-18-35-26(29-24)20-8-6-5-7-9-20/h5-16,18,30H,17H2,1-4H3