Vitas-M small molecule compound
propan-2-yl 2-ethyl-7-methyl-5-(3-nitrophenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK881082
SMILES CCC1SC2=NC(=C(C(N2C1=O)c1cccc(c1)[N+](=O)[O-])C(=O)OC(C)C)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/c1-5-14-17(23)21-16(12-7-6-8-13(9-12)22(25)26)15(18(24)27-10(2)3)11(4)20-19(21)28-14/h6-10,14,16H,5H2,1-4H3InChIKey
LFEPLMKZOTYFFP-UHFFFAOYSA-NSynonyms
836641-22-6836641226
CCC1C(=O)N2C(C(=C(N=C2S1)C)C(=O)OC(C)C)C3=CC(=CC=C3)(N+)(=O)(O)
CCC1SC2=NC(=C(C(N2C1=O)c1cccc(c1)(N+)(=O)(O))C(=O)OC(C)C)C
InChI=1SC19H21N3O5Sc151417(23)2116(1276813(912)22(25)26)15(18(24)2710(2)3)11(4)2019(21)2814h6101416H5H214H3
isopropyl2ethyl7methyl5(3nitrophenyl)3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
MFCD03690692
PROPAN2YL(2R5R)2ETHYL7METHYL5(3NITROPHENYL)3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
PROPAN2YL(2R5S)2ETHYL7METHYL5(3NITROPHENYL)3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
propan2yl2ethyl7methyl5(3nitrophenyl)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
PROPAN2YL2ETHYL7METHYL5(3NITROPHENYL)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ZINC000002251762
ZINC000002251765
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