Vitas-M small molecule compound

methyl 1-(2-methoxyethyl)-7-(3-nitrophenyl)-4-oxo-2-sulfanyl-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate

Catalog ID
STL179710
SMILES COCCn1c(S)nc(=O)c2c1nc(cc2C(=O)OC)c1cccc(c1)[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 C18H16N4O6S MW 416.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4O6S/c1-27-7-6-21-15-14(16(23)20-18(21)29)12(17(24)28-2)9-13(19-15)10-4-3-5-11(8-10)22(25)26/h3-5,8-9H,6-7H2,1-2H3,(H,20,23,29)
InChIKey
HNNQHPGJBIXHTG-UHFFFAOYSA-N
Synonyms
1011393-73-9
1011393739
COCCn1c(S)nc(=O)c2c1nc(cc2C(=O)OC)c1cccc(c1)(N+)(=O)(O)
COCCN1C2=C(C(=CC(=N2)C3=CC(=CC=C3)(N+)(=O)(O))C(=O)OC)C(=O)NC1=S
InChI=1SC18H16N4O6Sc12776211514(16(23)2018(21)29)12(17(24)282)913(1915)1043511(810)22(25)26h3589H67H212H3(H202329)
methyl1(2methoxyethyl)7(3nitrophenyl)4oxo2sulfanyl14dihydropyrido(23d)pyrimidine5carboxylate
methyl1(2methoxyethyl)7(3nitrophenyl)4oxo2sulfanylidenepyrido(23d)pyrimidine5carboxylate
MFCD09473280
ZINC000020605697
ZINC20605697

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Available files

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