Vitas-M small molecule compound
5-(5-chloro-2-methoxyphenyl)-3-(1,3-dimethyl-1H-pyrazol-4-yl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Catalog ID
STL239965
SMILES COc1ccc(cc1N1C(=O)C2C(C1=O)C(=NO2)c1cn(nc1C)C)Cl
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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 C17H15ClN4O4 MW 374.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15ClN4O4/c1-8-10(7-21(2)19-8)14-13-15(26-20-14)17(24)22(16(13)23)11-6-9(18)4-5-12(11)25-3/h4-7,13,15H,1-3H3InChIKey
HBSIKVMRKLNXKS-UHFFFAOYSA-NSynonyms
(3aS6aR)5(5chloro2methoxyphenyl)3(13dimethyl1Hpyrazol4yl)3aHpyrrolo(34d)isoxazole46(5H6aH)dione
5(5chloro2methoxyphenyl)3(13dimethyl1Hpyrazol4yl)3aHpyrrolo(34d)(12)oxazole46(5H6aH)dione
5(5chloro2methoxyphenyl)3(13dimethylpyrazol4yl)3a6adihydropyrrolo(34d)(12)oxazole46dione
CC1=NN(C=C1C2=NOC3C2C(=O)N(C3=O)C4=C(C=CC(=C4)Cl)OC)C
COc1ccc(cc1N1C(=O)(C@H)2(C@@H)(C1=O)C(=NO2)c1cn(nc1C)C)Cl
InChI=1SC17H15ClN4O4c1810(721(2)198)141315(262014)17(24)22(16(13)23)1169(18)4512(11)253h471315H13H3
MFCD24858959
ZINC000101343689
ZINC000101343694
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