Vitas-M small molecule compound
N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1,5-dimethyl-4-nitro-1H-pyrazole-3-carboxamide
Catalog ID
STK304654
SMILES N#Cc1c(sc2c1CCC(C2)C(C)(C)C)NC(=O)c1nn(c(c1[N+](=O)[O-])C)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/c1-10-16(24(26)27)15(22-23(10)5)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
OIMBUSLHFAYFDI-UHFFFAOYSA-NSynonyms
1005631-64-01005631640
CC1=C(C(=NN1C)C(=O)NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C#N)(N+)(=O)(O)
InChI=1SC19H23N5O3Sc11016(24(26)27)15(2223(10)5)17(25)211813(920)127611(19(23)4)814(12)2818h11H68H215H3(H2125)
MFCD04043536
N#Cc1c(sc2c1CCC(C2)C(C)(C)C)NC(=O)c1nn(c(c1(N+)(=O)(O))C)C
N(6tertbutyl3cyano4567tetrahydro1benzothiophen2yl)15dimethyl4nitro1Hpyrazole3carboxamide
N(6tertbutyl3cyano4567tetrahydro1benzothiophen2yl)15dimethyl4nitropyrazole3carboxamide
ZINC000002781594
ZINC000002781595
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