Vitas-M small molecule compound
3-(2,3-dimethylphenyl)-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STL076369
SMILES O=C(N1CCCC1)CSc1nc2ccsc2c(=O)n1c1cccc(c1C)C
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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 C20H21N3O2S2 MW 399.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O2S2/c1-13-6-5-7-16(14(13)2)23-19(25)18-15(8-11-26-18)21-20(23)27-12-17(24)22-9-3-4-10-22/h5-8,11H,3-4,9-10,12H2,1-2H3InChIKey
LMRZOFNSUCCCOS-UHFFFAOYSA-NSynonyms
3(23dimethylphenyl)2((2oxo2(pyrrolidin1yl)ethyl)sulfanyl)thieno(32d)pyrimidin4(3H)one
3(23dimethylphenyl)2(2oxo2pyrrolidin1ylethyl)sulfanylthieno(32d)pyrimidin4one
CC1=C(C(=CC=C1)N2C(=O)C3=C(C=CS3)N=C2SCC(=O)N4CCCC4)C
InChI=1SC20H21N3O2S2c11365716(14(13)2)2319(25)1815(8112618)2120(23)271217(24)229341022h5811H3491012H212H3
MFCD18197601
ZINC000057488373
ZINC57488373
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