Vitas-M small molecule compound
5-(2-ethoxy-5-{[2-(pyridin-3-yl)piperidin-1-yl]sulfonyl}phenyl)-1-methyl-3-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Catalog ID
STL563475
SMILES CCCc1nn(c2c1nc([nH]c2=O)c1cc(ccc1OCC)S(=O)(=O)N1CCCCC1c1cccnc1)C
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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 C27H32N6O4S MW 536.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N6O4S/c1-4-9-21-24-25(32(3)31-21)27(34)30-26(29-24)20-16-19(12-13-23(20)37-5-2)38(35,36)33-15-7-6-11-22(33)18-10-8-14-28-17-18/h8,10,12-14,16-17,22H,4-7,9,11,15H2,1-3H3,(H,29,30,34)InChIKey
BTXDFGAOFBDPGY-UHFFFAOYSA-NSynonyms
135539277
5(2ethoxy5((2(pyridin3yl)piperidin1yl)sulfonyl)phenyl)1methyl3propyl16dihydro7Hpyrazolo(43d)pyrimidin7one
5(2ETHOXY5((2(PYRIDIN3YL)PIPERIDIN1YL)SULFONYL)PHENYL)1METHYL3PROPYL1HPYRAZOLO(43D)PYRIMIDIN7(6H)ONE
5(2ethoxy5(2pyridin3ylpiperidin1yl)sulfonylphenyl)1methyl3propyl6Hpyrazolo(43d)pyrimidin7one
CCCc1nn(c2c1nc((nH)c2=O)c1cc(ccc1OCC)S(=O)(=O)N1CCCCC1c1cccnc1)C
InChI=1SC27H32N6O4Sc149212425(32(3)3121)27(34)3026(2924)201619(121323(20)3752)38(3536)3315761122(33)1810814281718h8101214161722H4791115H213H3(H293034)
MFCD01960532
ZINC000006079550
ZINC000006488868
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