Vitas-M small molecule compound
(2-{[3-(methoxycarbonyl)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-2-oxoethoxy)acetic acid
Catalog ID
STK464933
SMILES COC(=O)c1c(NC(=O)COCC(=O)O)sc2c1CCC(C2)c1ccccc1
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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 C20H21NO6S MW 403.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO6S/c1-26-20(25)18-14-8-7-13(12-5-3-2-4-6-12)9-15(14)28-19(18)21-16(22)10-27-11-17(23)24/h2-6,13H,7-11H2,1H3,(H,21,22)(H,23,24)InChIKey
CHJDTDZDRVWYCF-UHFFFAOYSA-NSynonyms
(2((3(methoxycarbonyl)6phenyl4567tetrahydro1benzothiophen2yl)amino)2oxoethoxy)aceticacid
2(2((3methoxycarbonyl6phenyl4567tetrahydro1benzothiophen2yl)amino)2oxoethoxy)aceticacid
COC(=O)C1=C(SC2=C1CCC(C2)C3=CC=CC=C3)NC(=O)COCC(=O)O
InChI=1SC20H21NO6Sc12620(25)18148713(125324612)915(14)2819(18)2116(22)10271117(23)24h2613H711H21H3(H2122)(H2324)
MFCD06031053
ZINC000017082648
ZINC000017082649
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