2-[[5-(3-aminophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-1-(9H-fluoren-2-yl)ethanone (CHEBI:105105)

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ChEBI Name	2-[[5-(3-aminophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-1-(9H-fluoren-2-yl)ethanone

ChEBI ID	CHEBI:105105

Stars	This entity has been manually annotated by a third party.

Supplier Information

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Formula

C24H20N4OS

Net Charge

Average Mass

412.509

Monoisotopic Mass

412.13578

InChI

InChI=1S/C24H20N4OS/c1-28-23(17-6-4-7-19(25)13-17)26-27-24(28)30-14-22(29)16-9-10-21-18(12-16)11-15-5-2-3-8-20(15)21/h2-10,12-13H,11,14,25H2,1H3

InChIKey

YTDFAVNBAISVRJ-UHFFFAOYSA-N

SMILES

CN1C(=NN=C1SCC(=O)C2=CC3=C(C=C2)C4=CC=CC=C4C3)C5=CC(=CC=C5)N

Roles Classification
Biological Role(s):	xenobiotic A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means. (via fluorenes )

ChEBI Ontology
Outgoing	2-[[5-(3-aminophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-1-(9H-fluoren-2-yl)ethanone (CHEBI:105105) is a fluorenes (CHEBI:24059)