Vitas-M small molecule compound
ethyl 7-methyl-2-[(4-nitrobenzyl)sulfanyl]-4-oxo-5-(pyridin-3-yl)-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STK980973
SMILES CCOC(=O)C1=C(C)Nc2c(C1c1cccnc1)c(=O)[nH]c(n2)SCc1ccc(cc1)[N+](=O)[O-]
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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 C23H21N5O5S MW 479.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N5O5S/c1-3-33-22(30)17-13(2)25-20-19(18(17)15-5-4-10-24-11-15)21(29)27-23(26-20)34-12-14-6-8-16(9-7-14)28(31)32/h4-11,18H,3,12H2,1-2H3,(H2,25,26,27,29)InChIKey
RAWRFCOHQZNWNH-UHFFFAOYSA-NSynonyms
537663-60-8537663608
CCOC(=O)C1=C(C)Nc2c(C1c1cccnc1)c(=O)(nH)c(n2)SCc1ccc(cc1)(N+)(=O)(O)
CCOC(=O)C1=C(NC2=C(C1C3=CN=CC=C3)C(=O)N=C(N2)SCC4=CC=C(C=C4)(N+)(=O)(O))C
ethyl7methyl2((4nitrobenzyl)sulfanyl)4oxo5(pyridin3yl)3458tetrahydropyrido(23d)pyrimidine6carboxylate
ETHYL7METHYL2((4NITROPHENYL)METHYLSULFANYL)4OXO5PYRIDIN3YL58DIHYDRO1HPYRIDO(23D)PYRIMIDINE6CARBOXYLATE
InChI=1SC23H21N5O5Sc133322(30)1713(2)252019(18(17)155410241115)21(29)2723(2620)3412146816(9714)28(31)32h41118H312H212H3(H225262729)
MFCD05712654
ZINC000009393870
ZINC000009393872
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