Vitas-M small molecule compound

methyl 7-(furan-2-yl)-1-(3-methoxypropyl)-4-oxo-2-sulfanyl-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate

Catalog ID
STL179836
SMILES COCCCn1c(S)nc(=O)c2c1nc(cc2C(=O)OC)c1ccco1

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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 C17H17N3O5S MW 375.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O5S/c1-23-7-4-6-20-14-13(15(21)19-17(20)26)10(16(22)24-2)9-11(18-14)12-5-3-8-25-12/h3,5,8-9H,4,6-7H2,1-2H3,(H,19,21,26)
InChIKey
RWRALYITTUGXMY-UHFFFAOYSA-N
Synonyms
1011361-08-2
1011361082
COCCCN1C2=C(C(=CC(=N2)C3=CC=CO3)C(=O)OC)C(=O)NC1=S
InChI=1SC17H17N3O5Sc123746201413(15(21)1917(20)26)10(16(22)242)911(1814)125382512h3589H467H212H3(H192126)
methyl7(furan2yl)1(3methoxypropyl)4oxo2sulfanyl14dihydropyrido(23d)pyrimidine5carboxylate
methyl7(furan2yl)1(3methoxypropyl)4oxo2sulfanylidenepyrido(23d)pyrimidine5carboxylate
MFCD09469125
ZINC000036614266
ZINC36614266

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.