Vitas-M small molecule compound
[1-(3-methylbutyl)-2,4-dioxo-1,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-3(2H)-yl]acetic acid
Catalog ID
STK616957
SMILES CC(CCn1c(=O)n(CC(=O)O)c(=O)c2c1sc1c2CCCC1)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 C17H22N2O4S MW 350.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2O4S/c1-10(2)7-8-18-16-14(11-5-3-4-6-12(11)24-16)15(22)19(17(18)23)9-13(20)21/h10H,3-9H2,1-2H3,(H,20,21)InChIKey
CZZRADZJDLRLQL-UHFFFAOYSA-NSynonyms
904008-62-4(1(3methylbutyl)24dioxo145678hexahydro(1)benzothieno(23d)pyrimidin3(2H)yl)aceticacid
2(1(3methylbutyl)24dioxo5678tetrahydro(1)benzothiolo(23d)pyrimidin3yl)aceticacid
2(1isopentyl24dioxo125678hexahydrobenzo(45)thieno(23d)pyrimidin3(4H)yl)aceticacid
904008624
CC(C)CCN1C2=C(C3=C(S2)CCCC3)C(=O)N(C1=O)CC(=O)O
InChI=1SC17H22N2O4Sc110(2)78181614(11534612(11)2416)15(22)19(17(18)23)913(20)21h10H39H212H3(H2021)
MFCD08292773
ZINC000006764277
ZINC6764277
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