Vitas-M small molecule compound
N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-1,5-dimethyl-4-nitro-1H-pyrazole-3-carboxamide
Catalog ID
STK304066
SMILES N#Cc1c(NC(=O)c2nn(c(c2[N+](=O)[O-])C)C)sc2c1CCC2
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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 C14H13N5O3S MW 331.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13N5O3S/c1-7-12(19(21)22)11(17-18(7)2)13(20)16-14-9(6-15)8-4-3-5-10(8)23-14/h3-5H2,1-2H3,(H,16,20)InChIKey
LQFQIYHOZWQVSK-UHFFFAOYSA-NSynonyms
1005627-31-51005627315
CC1=C(C(=NN1C)C(=O)NC2=C(C3=C(S2)CCC3)C#N)(N+)(=O)(O)
InChI=1SC14H13N5O3Sc1712(19(21)22)11(1718(7)2)13(20)16149(615)843510(8)2314h35H212H3(H1620)
MFCD04043946
N#Cc1c(NC(=O)c2nn(c(c2(N+)(=O)(O))C)C)sc2c1CCC2
N(3cyano56dihydro4Hcyclopenta(b)thiophen2yl)15dimethyl4nitro1Hpyrazole3carboxamide
N(3cyano56dihydro4Hcyclopenta(b)thiophen2yl)15dimethyl4nitropyrazole3carboxamide
ZINC000002779267
ZINC02779267
ZINC2779267
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