EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:43565 - 2-AMINO-6-AMINOMETHYL-8-PHENYLSULFANYLMETHYL-3H-QUINAZOLIN-4-ONE

Default Structure
ChEBI IDCHEBI:43565
ChEBI Name2-AMINO-6-AMINOMETHYL-8-PHENYLSULFANYLMETHYL-3H-QUINAZOLIN-4-ONE
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC16H16N4OS
Net Charge0
Average Mass312.398
Monoisotopic Mass312.10448
SMILES[H]c1c([H])c([H])c(SC([H])([H])c2c([H])c(C([H])([H])N([H])[H])c([H])c3c(=O)n([H])c(N([H])[H])nc23)c([H])c1[H]
InChIInChI=1S/C16H16N4OS/c17-8-10-6-11(9-22-12-4-2-1-3-5-12)14-13(7-10)15(21)20-16(18)19-14/h1-7H,8-9,17H2,(H3,18,19,20,21)
InChIKeyCBFXRTSHUMEYKQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-AMINO-6-AMINOMETHYL-8-PHENYLSULFANYLMETHYL-3H-QUINAZOLIN-4-ONE (CHEBI:43565) is a unclassifieds (CHEBI:27189)
Synonyms  Source
2-AMINO-6-AMINOMETHYL-8-PHENYLSULFANYLMETHYL-3H-QUINAZOLIN-4-ONEPDBeChem
2-amino-6-(aminomethyl)-8-[(phenylsulfanyl)methyl]quinazolin-4(3H)-onePDBeChem
Manual XrefsDatabases
KMBPDBeChem