Vitas-M small molecule compound
4-(7-methyl-4-oxo-1,2,3,4,5,6,7,8-octahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)phenyl (2E)-3-(furan-2-yl)prop-2-enoate
Catalog ID
STK382115
SMILES CC1CCc2c(C1)sc1c2C(=O)NC(N1)c1ccc(cc1)OC(=O)/C=C/c1ccco1
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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 C24H22N2O4S MW 434.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N2O4S/c1-14-4-10-18-19(13-14)31-24-21(18)23(28)25-22(26-24)15-5-7-17(8-6-15)30-20(27)11-9-16-3-2-12-29-16/h2-3,5-9,11-12,14,22,26H,4,10,13H2,1H3,(H,25,28)/b11-9+InChIKey
XAEPHGUQAHDLDA-PKNBQFBNSA-NSynonyms
(4(7methyl4oxo235678hexahydro1H(1)benzothiolo(23d)pyrimidin2yl)phenyl)(E)3(furan2yl)prop2enoate
4(7methyl4oxo12345678octahydro(1)benzothieno(23d)pyrimidin2yl)phenyl(2E)3(furan2yl)prop2enoate
CC1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC=C(C=C4)OC(=O)C=CC5=CC=CO5
CC1CCc2c(C1)sc1c2C(=O)NC(N1)c1ccc(cc1)OC(=O)C=Cc1ccco1
InChI=1SC24H22N2O4Sc1144101819(1314)312421(18)23(28)2522(2624)155717(8615)3020(27)1191632122916h23591112142226H41013H21H3(H2528)b119+
MFCD02915427
ZINC000008722326
ZINC000008722329
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