Vitas-M small molecule compound

2-{[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]sulfanyl}-3-ethyl-6-methyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one

Catalog ID
STL084370
SMILES CCn1c(SCC(=O)N2CCCc3c2cccc3)nc2c(c1=O)[nH]c(c2)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 C20H22N4O2S MW 382.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O2S/c1-3-23-19(26)18-15(11-13(2)21-18)22-20(23)27-12-17(25)24-10-6-8-14-7-4-5-9-16(14)24/h4-5,7,9,11,21H,3,6,8,10,12H2,1-2H3
InChIKey
ZJRDRAUKHHSMSW-UHFFFAOYSA-N
Synonyms

2((2(34dihydroquinolin1(2H)yl)2oxoethyl)sulfanyl)3ethyl6methyl35dihydro4Hpyrrolo(32d)pyrimidin4one
2(2(34dihydro2Hquinolin1yl)2oxoethyl)sulfanyl3ethyl6methyl5Hpyrrolo(32d)pyrimidin4one
CCN1C(=O)C2=C(C=C(N2)C)N=C1SCC(=O)N3CCCC4=CC=CC=C43
CCn1c(SCC(=O)N2CCCc3c2cccc3)nc2c(c1=O)(nH)c(c2)C
InChI=1SC20H22N4O2Sc132319(26)1815(1113(2)2118)2220(23)271217(25)24106814745916(14)24h45791121H3681012H212H3
MFCD18202940
ZINC000057521718
ZINC57521718

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Available files

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