Vitas-M small molecule compound
{2-[(3-cyano-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethoxy}acetic acid
Catalog ID
STK466744
SMILES CCCC1CCc2c(C1)sc(c2C#N)NC(=O)COCC(=O)O
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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 C16H20N2O4S MW 336.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N2O4S/c1-2-3-10-4-5-11-12(7-17)16(23-13(11)6-10)18-14(19)8-22-9-15(20)21/h10H,2-6,8-9H2,1H3,(H,18,19)(H,20,21)InChIKey
SBFJCXFMIIDCAW-UHFFFAOYSA-NSynonyms
(2((3cyano6propyl4567tetrahydro1benzothiophen2yl)amino)2oxoethoxy)aceticacid
2(2((3cyano6propyl4567tetrahydro1benzothiophen2yl)amino)2oxoethoxy)aceticacid
CCCC1CCC2=C(C1)SC(=C2C#N)NC(=O)COCC(=O)O
InChI=1SC16H20N2O4Sc12310451112(717)16(2313(11)610)1814(19)822915(20)21h10H2689H21H3(H1819)(H2021)
MFCD06061075
ZINC000017070718
ZINC000017070719
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