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CHEBI:45678 - 5'-ACETYL-4-{[(2,4-DIMETHYLPHENYL)SULFONYL]AMINO}-2,2'-BITHIOPHENE-5-CARBOXYLIC ACID

Default Structure
ChEBI IDCHEBI:45678
ChEBI Name5'-ACETYL-4-{[(2,4-DIMETHYLPHENYL)SULFONYL]AMINO}-2,2'-BITHIOPHENE-5-CARBOXYLIC ACID
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC19H17NO5S3
Net Charge0
Average Mass435.548
Monoisotopic Mass435.02689
SMILES[H]OC(=O)c1sc(-c2sc(C(=O)C([H])([H])[H])c([H])c2[H])c([H])c1N([H])S(=O)(=O)c1c([H])c([H])c(C([H])([H])[H])c([H])c1C([H])([H])[H]
InChIInChI=1S/C19H17NO5S3/c1-10-4-7-17(11(2)8-10)28(24,25)20-13-9-16(27-18(13)19(22)23)15-6-5-14(26-15)12(3)21/h4-9,20H,1-3H3,(H,22,23)
InChIKeyCMHHNHDPPWDNAH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
5'-ACETYL-4-{[(2,4-DIMETHYLPHENYL)SULFONYL]AMINO}-2,2'-BITHIOPHENE-5-CARBOXYLIC ACID (CHEBI:45678) is a unclassifieds (CHEBI:27189)
Synonyms  Source
5'-acetyl-4-{[(2,4-dimethylphenyl)sulfonyl]amino}-2,2'-bithiophene-5-carboxylic acidPDBeChem
5'-ACETYL-4-{[(2,4-DIMETHYLPHENYL)SULFONYL]AMINO}-2,2'-BITHIOPHENE-5-CARBOXYLIC ACIDPDBeChem
Manual XrefsDatabases
SNHPDBeChem