Vitas-M small molecule compound

2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl [(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate

Catalog ID
STK239226
SMILES O=C(CSc1nc(C)cc(n1)C)OCC(=O)N1CCCc2c1cccc2

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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 C19H21N3O3S MW 371.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3O3S/c1-13-10-14(2)21-19(20-13)26-12-18(24)25-11-17(23)22-9-5-7-15-6-3-4-8-16(15)22/h3-4,6,8,10H,5,7,9,11-12H2,1-2H3
InChIKey
JNQXZXCVLKLUCN-UHFFFAOYSA-N
Synonyms

(2(34dihydro2Hquinolin1yl)2oxoethyl)2(46dimethylpyrimidin2yl)sulfanylacetate
2(34DIHYDROQUINOLIN1(2H)YL)2OXOETHYL((46DIMETHYLPYRIMIDIN2YL)SULFANYL)ACETATE
CC1=CC(=NC(=N1)SCC(=O)OCC(=O)N2CCCC3=CC=CC=C32)C
InChI=1SC19H21N3O3Sc1131014(2)2119(2013)261218(24)251117(23)2295715634816(15)22h346810H5791112H212H3
MFCD03469691
ZINC000008659052
ZINC08659052
ZINC8659052

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Available files

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