Vitas-M small molecule compound

2-(biphenyl-4-yl)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one

Catalog ID
STK471431
SMILES O=c1c2ccccc2nc2n1nc(s2)c1ccc(cc1)c1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C21H13N3OS MW 355.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13N3OS/c25-20-17-8-4-5-9-18(17)22-21-24(20)23-19(26-21)16-12-10-15(11-13-16)14-6-2-1-3-7-14/h1-13H
InChIKey
XJECMEQUDKTSCV-UHFFFAOYSA-N
Synonyms

2(4phenylphenyl)(134)thiadiazolo(23b)quinazolin5one
2(4PHENYLPHENYL)4HYDRO134THIADIAZOLINO(23B)QUINAZOLIN5ONE
2(biphenyl4yl)5H(134)thiadiazolo(23b)quinazolin5one
C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NN4C(=O)C5=CC=CC=C5N=C4S3
InChI=1SC21H13N3OSc252017845918(17)222124(20)2319(2621)16121015(111316)146213714h113H
MFCD07626134
ZINC000017073468
ZINC17073468

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.