Vitas-M small molecule compound
{4-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]phenyl}(thiomorpholin-4-yl)methanone
Catalog ID
STK825477
SMILES O=C(c1ccc(cc1)Cn1nc(cc1C)[N+](=O)[O-])N1CCSCC1
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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 C16H18N4O3S MW 346.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O3S/c1-12-10-15(20(22)23)17-19(12)11-13-2-4-14(5-3-13)16(21)18-6-8-24-9-7-18/h2-5,10H,6-9,11H2,1H3InChIKey
LYIFCYVXGURWLU-UHFFFAOYSA-NSynonyms
489408-09-5(4((5methyl3nitro1Hpyrazol1yl)methyl)phenyl)(thiomorpholin4yl)methanone
(4((5methyl3nitro1Hpyrazol1yl)methyl)phenyl)(thiomorpholino)methanone
(4((5METHYL3NITROPYRAZOL1YL)METHYL)PHENYL)THIOMORPHOLIN4YLMETHANONE
(4(5METHYL3NITROPYRAZOL1YLMETHYL)PHENYL)THIOMORPHOLIN4YLMETHANONE
4((5METHYL3NITROPYRAZOLYL)METHYL)PHENYL14THIAZAPERHYDROIN4YLKETONE
489408095
CC1=CC(=NN1CC2=CC=C(C=C2)C(=O)N3CCSCC3)(N+)(=O)(O)
InChI=1SC16H18N4O3Sc1121015(20(22)23)1719(12)11132414(5313)16(21)1868249718h2510H6911H21H3
MFCD01893374
O=C(c1ccc(cc1)Cn1nc(cc1C)(N+)(=O)(O))N1CCSCC1
ZINC000000551416
ZINC00551416
ZINC551416
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