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CHEBI:105315 - 2-[[[(6-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester

ChEBI IDCHEBI:105315
ChEBI Name2-[[[(6-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester
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FormulaC20H19N3O2S2
Net Charge0
Average Mass397.525
Monoisotopic Mass397.09187
SMILESCCOC(=O)c1cc(-c2ccccc2)sc1NC(=S)Nc1cccc(C)n1
InChIInChI=1S/C20H19N3O2S2/c1-3-25-19(24)15-12-16(14-9-5-4-6-10-14)27-18(15)23-20(26)22-17-11-7-8-13(2)21-17/h4-12H,3H2,1-2H3,(H2,21,22,23,26)
InChIKeyYWWWFWKNQUIDIL-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2-[[[(6-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester (CHEBI:105315) is a thiophenecarboxylic acid (CHEBI:48436)
Manual XrefsDatabases
LSM-16678LINCS