Vitas-M small molecule compound
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-nitro-1H-pyrazole-3-carboxamide
Catalog ID
STK306350
SMILES N#Cc1c(sc2c1CCCC2)NC(=O)c1n[nH]cc1[N+](=O)[O-]
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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 C13H11N5O3S MW 317.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11N5O3S/c14-5-8-7-3-1-2-4-10(7)22-13(8)16-12(19)11-9(18(20)21)6-15-17-11/h6H,1-4H2,(H,15,17)(H,16,19)InChIKey
ZVLGKBNSHHAZPE-UHFFFAOYSA-NSynonyms
1005614-74-31005614743
C1CCC2=C(C1)C(=C(S2)NC(=O)C3=C(C=NN3)(N+)(=O)(O))C#N
InChI=1SC13H11N5O3Sc14587312410(7)2213(8)1612(19)119(18(20)21)6151711h6H14H2(H1517)(H1619)
MFCD04129807
N#Cc1c(sc2c1CCCC2)NC(=O)c1n(nH)cc1(N+)(=O)(O)
N(3cyano4567tetrahydro1benzothiophen2yl)4nitro1Hpyrazole3carboxamide
N(3cyano4567tetrahydro1benzothiophen2yl)4nitro1Hpyrazole5carboxamide
ZINC000013959788
ZINC13959788
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