3-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]-5-phenyl-2-thenoic acid Formula: C21H21NO5S2 MolecularWeight: 431.52514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1S(=O)(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)O)C)C)OC

Isomeric SMILES

CC1=CC(=C(C(=C1S(=O)(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)O)C)C)OC

InChI

InChI=1S/C21H21NO5S2/c1-12-10-17(27-4)13(2)14(3)20(12)29(25,26)22-16-11-18(28-19(16)21(23)24)15-8-6-5-7-9-15/h5-11,22H,1-4H3,(H,23,24)