Vitas-M small molecule compound
methyl 2-[(2-fluorobenzyl)sulfanyl]-7-methyl-4-oxo-5-(pyridin-3-yl)-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STK980968
SMILES COC(=O)C1=C(C)Nc2c(C1c1cccnc1)c(=O)[nH]c(n2)SCc1ccccc1F
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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 C22H19FN4O3S MW 438.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19FN4O3S/c1-12-16(21(29)30-2)17(13-7-5-9-24-10-13)18-19(25-12)26-22(27-20(18)28)31-11-14-6-3-4-8-15(14)23/h3-10,17H,11H2,1-2H3,(H2,25,26,27,28)InChIKey
KJMDVLWPVXHOPW-UHFFFAOYSA-NSynonyms
537664-31-6537664316
CC1=C(C(C2=C(N1)NC(=NC2=O)SCC3=CC=CC=C3F)C4=CN=CC=C4)C(=O)OC
COC(=O)C1=C(C)Nc2c(C1c1cccnc1)c(=O)(nH)c(n2)SCc1ccccc1F
InChI=1SC22H19FN4O3Sc11216(21(29)302)17(13759241013)1819(2512)2622(2720(18)28)311114634815(14)23h31017H11H212H3(H225262728)
methyl2((2fluorobenzyl)sulfanyl)7methyl4oxo5(pyridin3yl)3458tetrahydropyrido(23d)pyrimidine6carboxylate
METHYL2((2FLUOROPHENYL)METHYLSULFANYL)7METHYL4OXO5PYRIDIN3YL58DIHYDRO1HPYRIDO(23D)PYRIMIDINE6CARBOXYLATE
MFCD04457453
ZINC000009393890
ZINC000009393893
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