Vitas-M small molecule compound

2-methylpropyl 8-methyl-6-(2-nitrophenyl)-4-oxo-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate

Catalog ID
STK814734
SMILES CC(COC(=O)C1=C(C)N=C2N(C1c1ccccc1[N+](=O)[O-])C(=O)CCS2)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 C19H21N3O5S MW 403.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3O5S/c1-11(2)10-27-18(24)16-12(3)20-19-21(15(23)8-9-28-19)17(16)13-6-4-5-7-14(13)22(25)26/h4-7,11,17H,8-10H2,1-3H3
InChIKey
VVELYOAROWABBY-UHFFFAOYSA-N
Synonyms
618080-13-0
2METHYLPROPYL(6R)8METHYL6(2NITROPHENYL)4OXO34DIHYDRO2H6HPYRIMIDO(21B)(13)THIAZINE7CARBOXYLATE
2METHYLPROPYL(6S)8METHYL6(2NITROPHENYL)4OXO34DIHYDRO2H6HPYRIMIDO(21B)(13)THIAZINE7CARBOXYLATE
2methylpropyl8methyl6(2nitrophenyl)4oxo34dihydro2H6Hpyrimido(21b)(13)thiazine7carboxylate
2METHYLPROPYL8METHYL6(2NITROPHENYL)4OXO36DIHYDRO2HPYRIMIDO(21B)(13)THIAZINE7CARBOXYLATE
618080130
CC(COC(=O)C1=C(C)N=C2N(C1c1ccccc1(N+)(=O)(O))C(=O)CCS2)C
CC1=C(C(N2C(=O)CCSC2=N1)C3=CC=CC=C3(N+)(=O)(O))C(=O)OCC(C)C
InChI=1SC19H21N3O5Sc111(2)102718(24)1612(3)201921(15(23)892819)17(16)13645714(13)22(25)26h471117H810H213H3
MFCD03530013
ZINC000002502908
ZINC000002502909

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Available files

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