Vitas-M small molecule compound
(3aS,6aR)-5-(4-chlorophenyl)-3-(1,5-dimethyl-1H-pyrazol-4-yl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Catalog ID
STK628085
SMILES Clc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C(=NO2)c1cnn(c1C)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 C16H13ClN4O3 MW 344.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClN4O3/c1-8-11(7-18-20(8)2)13-12-14(24-19-13)16(23)21(15(12)22)10-5-3-9(17)4-6-10/h3-7,12,14H,1-2H3/t12-,14+/m0/s1InChIKey
OAFCXRAKTZWPOZ-GXTWGEPZSA-NSynonyms
1014409-12-1(3aS6aR)5(4chlorophenyl)3(15dimethyl1Hpyrazol4yl)3aHpyrrolo(34d)(12)oxazole46(5H6aH)dione
(3aS6aR)5(4chlorophenyl)3(15dimethyl1Hpyrazol4yl)3aHpyrrolo(34d)isoxazole46(5H6aH)dione
(3aS6aR)5(4chlorophenyl)3(15dimethylpyrazol4yl)3a6adihydropyrrolo(34d)(12)oxazole46dione
1014409121
CC1=C(C=NN1C)C2=NOC3C2C(=O)N(C3=O)C4=CC=C(C=C4)Cl
Clc1ccc(cc1)N1C(=O)(C@H)2(C@@H)(C1=O)C(=NO2)c1cnn(c1C)C
InChI=1SC16H13ClN4O3c1811(71820(8)2)131214(241913)16(23)21(15(12)22)10539(17)4610h371214H12H3t1214+m0s1
MFCD18246494
ZINC000101497879
ZINC101497879
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