Vitas-M small molecule compound

methyl 4-(6-oxo-6,7-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-3(4H)-yl)benzoate

Catalog ID
STK610383
SMILES COC(=O)c1ccc(cc1)N1CN=C2N(C1)C(=O)CS2

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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 C13H13N3O3S MW 291.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N3O3S/c1-19-12(18)9-2-4-10(5-3-9)15-7-14-13-16(8-15)11(17)6-20-13/h2-5H,6-8H2,1H3
InChIKey
LWLIKHQDLUTKMS-UHFFFAOYSA-N
Synonyms
903194-74-1
903194741
COC(=O)C1=CC=C(C=C1)N2CN=C3N(C2)C(=O)CS3
InChI=1SC13H13N3O3Sc11912(18)92410(539)157141316(815)11(17)62013h25H68H21H3
METHYL4(6OXO24DIHYDRO(13)THIAZOLO(32A)(135)TRIAZIN3YL)BENZOATE
methyl4(6oxo67dihydro2H(13)thiazolo(32a)(135)triazin3(4H)yl)benzoate
methyl4(6oxo67dihydro2Hthiazolo(32a)(135)triazin3(4H)yl)benzoate
MFCD08288497
ZINC000006672194
ZINC06672194
ZINC6672194

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Available files

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