Vitas-M small molecule compound
methyl [2,4-dioxo-3-(4H-1,2,4-triazol-4-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]acetate
Catalog ID
STK658884
SMILES COC(=O)Cn1c2sc3c(c2c(=O)n(c1=O)n1cnnc1)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 C15H15N5O4S MW 361.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15N5O4S/c1-24-11(21)6-19-14-12(9-4-2-3-5-10(9)25-14)13(22)20(15(19)23)18-7-16-17-8-18/h7-8H,2-6H2,1H3InChIKey
SBXSXXDUZSHYEW-UHFFFAOYSA-NSynonyms
1144437-67-11144437671
COC(=O)CN1C2=C(C3=C(S2)CCCC3)C(=O)N(C1=O)N4C=NN=C4
InChI=1SC15H15N5O4Sc12411(21)6191412(9423510(9)2514)13(22)20(15(19)23)1871617818h78H26H21H3
methyl(24dioxo3(4H124triazol4yl)345678hexahydro(1)benzothieno(23d)pyrimidin1(2H)yl)acetate
methyl2(24dioxo3(124triazol4yl)5678tetrahydro(1)benzothiolo(23d)pyrimidin1yl)acetate
methyl2(24dioxo3(4H124triazol4yl)345678hexahydrobenzo(45)thieno(23d)pyrimidin1(2H)yl)acetate
MFCD12211483
ZINC000032072256
ZINC32072256
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