Vitas-M small molecule compound
3-cyclohexyl-2-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK271661
SMILES O=C(c1ccc(cc1)[N+](=O)[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 C24H25N3O4S2 MW 483.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O4S2/c28-19(15-10-12-17(13-11-15)27(30)31)14-32-24-25-22-21(18-8-4-5-9-20(18)33-22)23(29)26(24)16-6-2-1-3-7-16/h10-13,16H,1-9,14H2InChIKey
OVYASPVHSCUCAG-UHFFFAOYSA-NSynonyms
3cyclohexyl2((2(4nitrophenyl)2oxoethyl)sulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3cyclohexyl2(2(4nitrophenyl)2oxoethyl)sulfanyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
C1CCC(CC1)N2C(=O)C3=C(N=C2SCC(=O)C4=CC=C(C=C4)(N+)(=O)(O))SC5=C3CCCC5
InChI=1SC24H25N3O4S2c2819(15101217(131115)27(30)31)143224252221(18845920(18)3322)23(29)26(24)166213716h101316H1914H2
MFCD05986059
O=C(c1ccc(cc1)(N+)(=O)(O))CSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CCCC3
ZINC000009614278
ZINC09614278
ZINC9614278
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