Vitas-M small molecule compound
methyl 2-[(2-fluorobenzyl)sulfanyl]-7-methyl-5-(4-nitrophenyl)-4-oxo-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STK980907
SMILES COC(=O)C1=C(C)Nc2c(C1c1ccc(cc1)[N+](=O)[O-])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 C23H19FN4O5S MW 482.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19FN4O5S/c1-12-17(22(30)33-2)18(13-7-9-15(10-8-13)28(31)32)19-20(25-12)26-23(27-21(19)29)34-11-14-5-3-4-6-16(14)24/h3-10,18H,11H2,1-2H3,(H2,25,26,27,29)InChIKey
VZDUPEOJCCBNJN-UHFFFAOYSA-NSynonyms
537663-77-7537663777
CC1=C(C(C2=C(N1)NC(=NC2=O)SCC3=CC=CC=C3F)C4=CC=C(C=C4)(N+)(=O)(O))C(=O)OC
COC(=O)C1=C(C)Nc2c(C1c1ccc(cc1)(N+)(=O)(O))c(=O)(nH)c(n2)SCc1ccccc1F
InChI=1SC23H19FN4O5Sc11217(22(30)332)18(137915(10813)28(31)32)1920(2512)2623(2721(19)29)341114534616(14)24h31018H11H212H3(H225262729)
methyl2((2fluorobenzyl)sulfanyl)7methyl5(4nitrophenyl)4oxo3458tetrahydropyrido(23d)pyrimidine6carboxylate
METHYL2((2FLUOROPHENYL)METHYLSULFANYL)7METHYL5(4NITROPHENYL)4OXO58DIHYDRO1HPYRIDO(23D)PYRIMIDINE6CARBOXYLATE
MFCD04457451
ZINC000100821762
ZINC000100821764
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