Vitas-M small molecule compound
methyl [(3-butyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
Catalog ID
STK996273
SMILES CCCCn1c(SCC(=O)OC)nc2c(c1=O)c1CCCCc1s2
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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 C17H22N2O3S2 MW 366.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2O3S2/c1-3-4-9-19-16(21)14-11-7-5-6-8-12(11)24-15(14)18-17(19)23-10-13(20)22-2/h3-10H2,1-2H3InChIKey
ISTOLVKZWBWWSR-UHFFFAOYSA-NSynonyms
CCCCN1C(=O)C2=C(N=C1SCC(=O)OC)SC3=C2CCCC3
InChI=1SC17H22N2O3S2c13491916(21)1411756812(11)2415(14)1817(19)231013(20)222h310H212H3
methyl((3butyl4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetate
methyl2((3butyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetate
MFCD02631132
ZINC000002115860
ZINC02115860
ZINC2115860
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