Vitas-M small molecule compound
N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-methyl-3-nitrobenzamide
Catalog ID
STK388346
SMILES N#Cc1c(NC(=O)c2cccc(c2C)[N+](=O)[O-])sc2c1CCC(C2)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 C18H17N3O3S MW 355.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O3S/c1-10-6-7-13-14(9-19)18(25-16(13)8-10)20-17(22)12-4-3-5-15(11(12)2)21(23)24/h3-5,10H,6-8H2,1-2H3,(H,20,22)InChIKey
OINXLZPTIJURMU-UHFFFAOYSA-NSynonyms
352650-93-2352650932
CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=C(C(=CC=C3)(N+)(=O)(O))C
InChI=1SC18H17N3O3Sc110671314(919)18(2516(13)810)2017(22)1243515(11(12)2)21(23)24h3510H68H212H3(H2022)
MFCD01107298
N#Cc1c(NC(=O)c2cccc(c2C)(N+)(=O)(O))sc2c1CCC(C2)C
N(3cyano6methyl4567tetrahydro1benzothiophen2yl)2methyl3nitrobenzamide
ZINC000000799292
ZINC000004109737
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