Vitas-M small molecule compound

ethyl 2,7-dimethyl-5-(2-nitrophenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK705665
SMILES CCOC(=O)C1=C(C)N=C2N(C1c1ccccc1[N+](=O)[O-])C(=O)C(S2)C

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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/c1-4-25-16(22)13-9(2)18-17-19(15(21)10(3)26-17)14(13)11-7-5-6-8-12(11)20(23)24/h5-8,10,14H,4H2,1-3H3
InChIKey
FTHVLVGTQCRHIO-UHFFFAOYSA-N
Synonyms
620551-32-8
620551328
CCOC(=O)C1=C(C)N=C2N(C1c1ccccc1(N+)(=O)(O))C(=O)C(S2)C
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3(N+)(=O)(O))C(=O)C(S2)C)C
ethyl27dimethyl5(2nitrophenyl)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL27DIMETHYL5(2NITROPHENYL)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC17H17N3O5Sc142516(22)139(2)181719(15(21)10(3)2617)14(13)11756812(11)20(23)24h581014H4H213H3
MFCD04446807
ZINC000003636509
ZINC000003636516

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Available files

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