Vitas-M small molecule compound
N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1,3-dimethyl-4-nitro-1H-pyrazole-5-carboxamide
Catalog ID
STK304667
SMILES N#Cc1c(sc2c1CCC(C2)C(C)(C)C)NC(=O)c1n(C)nc(c1[N+](=O)[O-])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 C19H23N5O3S MW 401.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N5O3S/c1-10-15(24(26)27)16(23(5)22-10)17(25)21-18-13(9-20)12-7-6-11(19(2,3)4)8-14(12)28-18/h11H,6-8H2,1-5H3,(H,21,25)InChIKey
OFOYCZOABSYURM-UHFFFAOYSA-NSynonyms
1005631-71-91005631719
CC1=NN(C(=C1(N+)(=O)(O))C(=O)NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C#N)C
InChI=1SC19H23N5O3Sc11015(24(26)27)16(23(5)2210)17(25)211813(920)127611(19(23)4)814(12)2818h11H68H215H3(H2125)
MFCD04049867
N#Cc1c(sc2c1CCC(C2)C(C)(C)C)NC(=O)c1n(C)nc(c1(N+)(=O)(O))C
N(6tertbutyl3cyano4567tetrahydro1benzothiophen2yl)13dimethyl4nitro1Hpyrazole5carboxamide
N(6tertbutyl3cyano4567tetrahydro1benzothiophen2yl)25dimethyl4nitropyrazole3carboxamide
ZINC000002781627
ZINC000002781628
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