Vitas-M small molecule compound
N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetamide
Catalog ID
STL386958
SMILES N#Cc1c(NC(=O)Cn2nc(c(c2C)[N+](=O)[O-])C)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 C17H19N5O3S MW 373.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N5O3S/c1-9-4-5-12-13(7-18)17(26-14(12)6-9)19-15(23)8-21-11(3)16(22(24)25)10(2)20-21/h9H,4-6,8H2,1-3H3,(H,19,23)InChIKey
OWTOGHIELDVXKV-UHFFFAOYSA-NSynonyms
355805-31-1355805311
CC1CCC2=C(C1)SC(=C2C#N)NC(=O)CN3C(=C(C(=N3)C)(N+)(=O)(O))C
InChI=1SC17H19N5O3Sc19451213(718)17(2614(12)69)1915(23)82111(3)16(22(24)25)10(2)2021h9H468H213H3(H1923)
MFCD01243836
N#Cc1c(NC(=O)Cn2nc(c(c2C)(N+)(=O)(O))C)sc2c1CCC(C2)C
N(3cyano6methyl4567tetrahydro1benzothiophen2yl)2(35dimethyl4nitro1Hpyrazol1yl)acetamide
N(3cyano6methyl4567tetrahydro1benzothiophen2yl)2(35dimethyl4nitropyrazol1yl)acetamide
ZINC000000845142
ZINC000000845143
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