Vitas-M small molecule compound

(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-ylsulfanyl)acetic acid

Catalog ID
STK913975
SMILES OC(=O)CSc1ncnc2c1c1CCCCc1s2

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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 C12H12N2O2S2 MW 280.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N2O2S2/c15-9(16)5-17-11-10-7-3-1-2-4-8(7)18-12(10)14-6-13-11/h6H,1-5H2,(H,15,16)
InChIKey
GFFWEDHEGYCZHG-UHFFFAOYSA-N
Synonyms
40277-59-6
(5678tetrahydro(1)benzothieno(23d)pyrimidin4ylsulfanyl)aceticacid
2((5678tetrahydrobenzo(45)thieno(23d)pyrimidin4yl)thio)aceticacid
2(5678tetrahydro(1)benzothiolo(23d)pyrimidin4ylsulfanyl)aceticacid
40277596
C1CCC2=C(C1)C3=C(S2)N=CN=C3SCC(=O)O
InChI=1SC12H12N2O2S2c159(16)5171110731248(7)1812(10)1461311h6H15H2(H1516)
MFCD00434891
ZINC000000189978
ZINC189978

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Available files

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