Vitas-M small molecule compound

N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-methyl-1H-pyrazole-4-carboxamide

Catalog ID
STL401926
SMILES N#Cc1c(NC(=O)c2cnn(c2)C)sc2c1CCCC2

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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 C14H14N4OS MW 286.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14N4OS/c1-18-8-9(7-16-18)13(19)17-14-11(6-15)10-4-2-3-5-12(10)20-14/h7-8H,2-5H2,1H3,(H,17,19)
InChIKey
SPMBUIVFJKXDON-UHFFFAOYSA-N
Synonyms
1005651-30-8
1005651308
CN1C=C(C=N1)C(=O)NC2=C(C3=C(S2)CCCC3)C#N
InChI=1SC14H14N4OSc11889(71618)13(19)171411(615)10423512(10)2014h78H25H21H3(H1719)
MFCD04050505
N(3cyano4567tetrahydro1benzothiophen2yl)1methyl1Hpyrazole4carboxamide
N(3cyano4567tetrahydro1benzothiophen2yl)1methylpyrazole4carboxamide
ZINC000002777959
ZINC02777959
ZINC2777959

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.