Vitas-M small molecule compound

2-(1,3-benzothiazol-2-yl)-1-(2,4-dihydroxy-3-methylphenyl)ethanone

Catalog ID
STK888137
SMILES O=C(c1ccc(c(c1O)C)O)Cc1nc2c(s1)cccc2

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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 C16H13NO3S MW 299.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13NO3S/c1-9-12(18)7-6-10(16(9)20)13(19)8-15-17-11-4-2-3-5-14(11)21-15/h2-7,18,20H,8H2,1H3
InChIKey
PVVJYGDMKPYKEJ-UHFFFAOYSA-N
Synonyms
610757-67-0
2(13BENZOTHIAZOL2YL)1(24DIHYDROXY3METHYLPHENYL)ETHAN1ONE
2(13benzothiazol2yl)1(24dihydroxy3methylphenyl)ethanone
2(BENZO(D)THIAZOL2YL)1(24DIHYDROXY3METHYLPHENYL)ETHANONE
2BENZOTHIAZOL2YL1(24DIHYDROXY3METHYLPHENYL)ETHAN1ONE
610757670
CC1=C(C=CC(=C1O)C(=O)CC2=NC3=CC=CC=C3S2)O
InChI=1SC16H13NO3Sc1912(18)7610(16(9)20)13(19)8151711423514(11)2115h271820H8H21H3
MFCD03469449
ZINC000000544192
ZINC00544192
ZINC544192

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Available files

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