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CHEBI:112246 - 1-[2,4-dimethyl-5-[2-[(phenylmethyl)amino]-4H-1,3,4-thiadiazin-5-ylidene]-3-pyrrolyl]ethanone

Default Structure
ChEBI IDCHEBI:112246
ChEBI Name1-[2,4-dimethyl-5-[2-[(phenylmethyl)amino]-4H-1,3,4-thiadiazin-5-ylidene]-3-pyrrolyl]ethanone
Stars
DownloadsMolfile
FormulaC18H20N4OS
Net Charge0
Average Mass340.452
Monoisotopic Mass340.13578
SMILESCC(=O)C1=C(C)C(=C2CSC(NCc3ccccc3)=NN2)N=C1C
InChIInChI=1S/C18H20N4OS/c1-11-16(13(3)23)12(2)20-17(11)15-10-24-18(22-21-15)19-9-14-7-5-4-6-8-14/h4-8,21H,9-10H2,1-3H3,(H,19,22)
InChIKeyIVMDJRGRIRNIBC-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
1-[2,4-dimethyl-5-[2-[(phenylmethyl)amino]-4H-1,3,4-thiadiazin-5-ylidene]-3-pyrrolyl]ethanone (CHEBI:112246) is a aralkylamine (CHEBI:18000)
Manual XrefsDatabases
LSM-23658LINCS