Vitas-M small molecule compound
(3aS,6aR)-3-(1,5-dimethyl-1H-pyrazol-4-yl)-5-(naphthalen-2-yl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Catalog ID
STK618445
SMILES O=C1N(c2ccc3c(c2)cccc3)C(=O)[C@@H]2[C@H]1ON=C2c1cnn(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 C20H16N4O3 MW 360.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N4O3/c1-11-15(10-21-23(11)2)17-16-18(27-22-17)20(26)24(19(16)25)14-8-7-12-5-3-4-6-13(12)9-14/h3-10,16,18H,1-2H3/t16-,18+/m0/s1InChIKey
GLOLZFARZHROEH-FUHWJXTLSA-NSynonyms
1014102-76-1(3aS6aR)3(15dimethyl1Hpyrazol4yl)5(naphthalen2yl)3aHpyrrolo(34d)(12)oxazole46(5H6aH)dione
(3aS6aR)3(15dimethyl1Hpyrazol4yl)5(naphthalen2yl)3aHpyrrolo(34d)isoxazole46(5H6aH)dione
(3aS6aR)3(15dimethylpyrazol4yl)5naphthalen2yl3a6adihydropyrrolo(34d)(12)oxazole46dione
1014102761
CC1=C(C=NN1C)C2=NOC3C2C(=O)N(C3=O)C4=CC5=CC=CC=C5C=C4
InChI=1SC20H16N4O3c11115(102123(11)2)171618(272217)20(26)24(19(16)25)148712534613(12)914h3101618H12H3t1618+m0s1
MFCD18246353
O=C1N(c2ccc3c(c2)cccc3)C(=O)(C@@H)2(C@H)1ON=C2c1cnn(c1C)C
ZINC000101510104
ZINC101510104
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