Vitas-M small molecule compound
[1-(2-methylprop-2-en-1-yl)-2,4-dioxo-1,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-3(2H)-yl]acetic acid
Catalog ID
STK602399
SMILES CC(=C)Cn1c2sc3c(c2c(=O)n(c1=O)CC(=O)O)CCCC3
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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 C16H18N2O4S MW 334.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O4S/c1-9(2)7-18-15-13(10-5-3-4-6-11(10)23-15)14(21)17(16(18)22)8-12(19)20/h1,3-8H2,2H3,(H,19,20)InChIKey
XAWFBFDTTQJFNO-UHFFFAOYSA-NSynonyms
904005-69-2(1(2methylprop2en1yl)24dioxo145678hexahydro(1)benzothieno(23d)pyrimidin3(2H)yl)aceticacid
2(1(2methylallyl)24dioxo125678hexahydrobenzo(45)thieno(23d)pyrimidin3(4H)yl)aceticacid
2(1(2methylprop2enyl)24dioxo5678tetrahydro(1)benzothiolo(23d)pyrimidin3yl)aceticacid
904005692
CC(=C)CN1C2=C(C3=C(S2)CCCC3)C(=O)N(C1=O)CC(=O)O
InChI=1SC16H18N2O4Sc19(2)7181513(10534611(10)2315)14(21)17(16(18)22)812(19)20h138H22H3(H1920)
MFCD08288398
ZINC000006755217
ZINC6755217
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