Vitas-M small molecule compound
methyl 4-{[(4-amino-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}benzoate
Catalog ID
STL079682
SMILES COC(=O)c1ccc(cc1)CSc1nc(N)c2c(n1)sc1c2CCCC1
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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 C19H19N3O2S2 MW 385.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O2S2/c1-24-18(23)12-8-6-11(7-9-12)10-25-19-21-16(20)15-13-4-2-3-5-14(13)26-17(15)22-19/h6-9H,2-5,10H2,1H3,(H2,20,21,22)InChIKey
YBGACINAOSJNQY-UHFFFAOYSA-NSynonyms
315695-13-7315695137
COC(=O)C1=CC=C(C=C1)CSC2=NC(=C3C4=C(CCCC4)SC3=N2)N
InChI=1SC19H19N3O2S2c12418(23)128611(7912)1025192116(20)1513423514(13)2617(15)2219h69H2510H21H3(H2202122)
methyl4(((4amino5678tetrahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)methyl)benzoate
methyl4((4amino5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanylmethyl)benzoate
MFCD02329908
ZINC000000715721
ZINC00715721
ZINC715721
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