3-[3-[(2-acetamido-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-5-phenyl-thiophen-2-yl]thiophene-2-carboxylic acid

Systemtic Name: 3-[3-[(2-acetamido-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-5-phenyl-thiophen-2-yl]thiophene-2-carboxylic acid Openeye Name: 3-[3-[(2-acetamido-4-methyl-thiazol-5-yl)sulfonylamino]-5-phenyl-2-thienyl]thiophene-2-carboxylic acid CAS Name: 3-[3-[(2-acetamido-4-methyl-5-thiazolyl)sulfonylamino]-5-phenyl-2-thiophenyl]-2-thiophenecarboxylic acid IUPAC Name: 3-[3-[(2-acetamido-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-5-phenylthiophen-2-yl]thiophene-2-carboxylic acid Traditional Name: 3-[3-[(2-acetamido-4-methyl-thiazol-5-yl)sulfonylamino]-5-phenyl-2-thienyl]-2-thenoic acid Formula: C21H17N3O5S4 MolecularWeight: 519.63678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C)S(=O)(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C4=C(SC=C4)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C)S(=O)(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C4=C(SC=C4)C(=O)O

InChI

InChI=1S/C21H17N3O5S4/c1-11-20(32-21(22-11)23-12(2)25)33(28,29)24-15-10-16(13-6-4-3-5-7-13)31-17(15)14-8-9-30-18(14)19(26)27/h3-10,24H,1-2H3,(H,26,27)(H,22,23,25)