Vitas-M small molecule compound
[(3-cyclohexyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetic acid
Catalog ID
STK062188
SMILES OC(=O)CSc1nc2sc3c(c2c(=O)n1C1CCCCC1)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 C18H22N2O3S2 MW 378.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O3S2/c21-14(22)10-24-18-19-16-15(12-8-4-5-9-13(12)25-16)17(23)20(18)11-6-2-1-3-7-11/h11H,1-10H2,(H,21,22)InChIKey
ROUDARNORWZKNE-UHFFFAOYSA-NSynonyms
331964-34-2((3cyclohexyl4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)aceticacid
2((3cyclohexyl4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)aceticacid
2((3cyclohexyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)aceticacid
331964342
C1CCC(CC1)N2C(=O)C3=C(N=C2SCC(=O)O)SC4=C3CCCC4
InChI=1SC18H22N2O3S2c2114(22)102418191615(12845913(12)2516)17(23)20(18)116213711h11H110H2(H2122)
MFCD01557169
OC(=O)CSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CCCC3
STK062188
ZINC000002350512
ZINC2350512
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