Vitas-M small molecule compound

1-butyl-3-[2-(5-chlorothiophen-2-yl)-2-oxoethyl]-3-hydroxy-1,3-dihydro-2H-indol-2-one

Catalog ID
STK214739
SMILES CCCCN1c2ccccc2C(C1=O)(O)CC(=O)c1ccc(s1)Cl

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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 C18H18ClNO3S MW 363.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClNO3S/c1-2-3-10-20-13-7-5-4-6-12(13)18(23,17(20)22)11-14(21)15-8-9-16(19)24-15/h4-9,23H,2-3,10-11H2,1H3
InChIKey
NQAYNPPBQDGBJQ-UHFFFAOYSA-N
Synonyms

1BUTYL3(2(5CHLORO(2THIENYL))2OXOETHYL)3HYDROXYINDOLIN2ONE
1BUTYL3(2(5CHLOROTHIOPHEN2YL)2OXOETHYL)3HYDROXY13DIHYDRO2HINDOL2ONE
1BUTYL3(2(5CHLOROTHIOPHEN2YL)2OXOETHYL)3HYDROXYINDOL2ONE
CCCCN1C2=CC=CC=C2C(C1=O)(CC(=O)C3=CC=C(S3)Cl)O
InChI=1SC18H18ClNO3Sc123102013754612(13)18(2317(20)22)1114(21)158916(19)2415h4923H231011H21H3
MFCD03837355
ZINC000004554958
ZINC000004554959

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Available files

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