Vitas-M small molecule compound
N-cyclooctyl-1-[7-(2-fluorophenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]piperidine-4-carboxamide
Catalog ID
STL097431
SMILES O=C(C1CCN(CC1)c1nc2c(csc2c(=O)[nH]1)c1ccccc1F)NC1CCCCCCC1
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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 C26H31FN4O2S MW 482.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31FN4O2S/c27-21-11-7-6-10-19(21)20-16-34-23-22(20)29-26(30-25(23)33)31-14-12-17(13-15-31)24(32)28-18-8-4-2-1-3-5-9-18/h6-7,10-11,16-18H,1-5,8-9,12-15H2,(H,28,32)(H,29,30,33)InChIKey
BMWQNJGPSZJOJP-UHFFFAOYSA-NSynonyms
1251623-11-61251623116
C1CCCC(CCC1)NC(=O)C2CCN(CC2)C3=NC(=O)C4=C(N3)C(=CS4)C5=CC=CC=C5F
InChI=1SC26H31FN4O2Sc272111761019(21)2016342322(20)2926(3025(23)33)31141217(131531)24(32)2818842135918h6710111618H15891215H2(H2832)(H293033)
MFCD18789104
Ncyclooctyl1(7(2fluorophenyl)4oxo1Hthieno(32d)pyrimidin2yl)piperidine4carboxamide
Ncyclooctyl1(7(2fluorophenyl)4oxo34dihydrothieno(32d)pyrimidin2yl)piperidine4carboxamide
O=C(C1CCN(CC1)c1nc2c(csc2c(=O)(nH)1)c1ccccc1F)NC1CCCCCCC1
ZINC000049421062
ZINC49421062
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