3-[(4-chloranyl-2,5-dimethyl-phenyl)sulfonylamino]-5-thiophen-3-yl-thiophene-2-carboxylic acid

Systemtic Name: 3-[(4-chloranyl-2,5-dimethyl-phenyl)sulfonylamino]-5-thiophen-3-yl-thiophene-2-carboxylic acid Openeye Name: 3-[(4-chloro-2,5-dimethyl-phenyl)sulfonylamino]-5-(3-thienyl)thiophene-2-carboxylic acid CAS Name: 3-[(4-chloro-2,5-dimethylphenyl)sulfonylamino]-5-(3-thiophenyl)-2-thiophenecarboxylic acid IUPAC Name: 3-[(4-chloro-2,5-dimethylphenyl)sulfonylamino]-5-thiophen-3-ylthiophene-2-carboxylic acid Traditional Name: 3-[(4-chloro-2,5-dimethyl-phenyl)sulfonylamino]-5-(3-thienyl)-2-thenoic acid Formula: C17H14ClNO4S3 MolecularWeight: 427.94536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)NC2=C(SC(=C2)C3=CSC=C3)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)NC2=C(SC(=C2)C3=CSC=C3)C(=O)O

InChI

InChI=1S/C17H14ClNO4S3/c1-9-6-15(10(2)5-12(9)18)26(22,23)19-13-7-14(11-3-4-24-8-11)25-16(13)17(20)21/h3-8,19H,1-2H3,(H,20,21)