CHEBI:105318 - 5-cyano-2-(methoxymethyl)-6-sulfanylidene-1H-pyridine-3-carboxylic acid methyl ester

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 5-cyano-2-(methoxymethyl)-6-sulfanylidene-1H-pyridine-3-carboxylic acid methyl ester ChEBI ID CHEBI:105318 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 C10H10N2O3S Net Charge 0 Average Mass 238.264 Monoisotopic Mass 238.04121 InChI InChI=1S/C10H10N2O3S/c1-14-5-8-7(10(13)15-2)3-6(4-11)9(16)12-8/h3H,5H2,1-2H3,(H,12,16) InChIKey SYPFPQUWMZYAMG-UHFFFAOYSA-N SMILES COCC1=C(C=C(C(=S)N1)C#N)C(=O)OC 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-cyano-2-(methoxymethyl)-6-sulfanylidene-1H-pyridine-3-carboxylic acid methyl ester (CHEBI:105318) is a aromatic carboxylic acid (CHEBI:33859) 5-cyano-2-(methoxymethyl)-6-sulfanylidene-1H-pyridine-3-carboxylic acid methyl ester (CHEBI:105318) is a pyridines (CHEBI:26421) Manual Xref Database LSM-16681 LINCS View more database links