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CHEBI:94112 - N-[[(4-methyl-1,2-dihydroisoquinolin-3-yl)amino]-sulfanylidenemethyl]benzamide

ChEBI IDCHEBI:94112
ChEBI NameN-[[(4-methyl-1,2-dihydroisoquinolin-3-yl)amino]-sulfanylidenemethyl]benzamide
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DownloadsMolfile
FormulaC18H17N3OS
Net Charge0
Average Mass323.421
Monoisotopic Mass323.10923
SMILESCC1=C(NC(=S)NC(=O)c2ccccc2)NCc2ccccc21
InChIInChI=1S/C18H17N3OS/c1-12-15-10-6-5-9-14(15)11-19-16(12)20-18(23)21-17(22)13-7-3-2-4-8-13/h2-10,19H,11H2,1H3,(H2,20,21,22,23)
InChIKeyPUBJFPLMXBDARU-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)
N-[[(4-methyl-1,2-dihydroisoquinolin-3-yl)amino]-sulfanylidenemethyl]benzamide (CHEBI:94112) is a benzoic acids (CHEBI:22723)
Manual XrefsDatabases
LSM-4719LINCS