Vitas-M small molecule compound
4-[(3-cyano-4-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxobutanoic acid
Catalog ID
STK995702
SMILES N#Cc1c(NC(=O)CCC(=O)O)sc2c1C(C)CCC2
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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 C14H16N2O3S MW 292.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N2O3S/c1-8-3-2-4-10-13(8)9(7-15)14(20-10)16-11(17)5-6-12(18)19/h8H,2-6H2,1H3,(H,16,17)(H,18,19)InChIKey
JSJJIXRTUMQSJY-UHFFFAOYSA-NSynonyms
4((3cyano4methyl4567tetrahydro1benzothiophen2yl)amino)4oxobutanoicacid
CC1CCCC2=C1C(=C(S2)NC(=O)CCC(=O)O)C#N
InChI=1SC14H16N2O3Sc183241013(8)9(715)14(2010)1611(17)5612(18)19h8H26H21H3(H1617)(H1819)
MFCD02631192
ZINC000000188230
ZINC000000188233
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