CHEBI:119947 - 5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxylic acid [2-[(1,1-dioxo-3-thiolanyl)-(2-methylpropyl)amino]-2-oxoethyl] ester

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ChEBI Name 5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxylic acid [2-[(1,1-dioxo-3-thiolanyl)-(2-methylpropyl)amino]-2-oxoethyl] ester ChEBI ID CHEBI:119947 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C18H25NO5S2 Net Charge 0 Average Mass 399.528 Monoisotopic Mass 399.11742 InChI InChI=1S/C18H25NO5S2/c1-12(2)9-19(14-6-7-26(22,23)11-14)17(20)10-24-18(21)16-8-13-4-3-5-15(13)25-16/h8,12,14H,3-7,9-11H2,1-2H3 InChIKey RDUQAOLDJRZPCF-UHFFFAOYSA-N SMILES CC(C)CN(C1CCS(=O)(=O)C1)C(=O)COC(=O)C2=CC3=C(S2)CCC3 Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing 5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxylic acid [2-[(1,1-dioxo-3-thiolanyl)-(2-methylpropyl)amino]-2-oxoethyl] ester (CHEBI:119947) is a thiophenecarboxylic acid (CHEBI:48436) Manual Xref Database LSM-31390 LINCS View more database links