Vitas-M small molecule compound
[6-(benzyloxy)-1H-indol-3-yl][4-(thiophen-2-ylmethyl)piperazin-1-yl]acetic acid
Catalog ID
STK660935
SMILES OC(=O)C(c1c[nH]c2c1ccc(c2)OCc1ccccc1)N1CCN(CC1)Cc1cccs1
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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 C26H27N3O3S MW 461.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O3S/c30-26(31)25(29-12-10-28(11-13-29)17-21-7-4-14-33-21)23-16-27-24-15-20(8-9-22(23)24)32-18-19-5-2-1-3-6-19/h1-9,14-16,25,27H,10-13,17-18H2,(H,30,31)InChIKey
VXQSREYWOPECFX-UHFFFAOYSA-NSynonyms
1144459-91-5(6(benzyloxy)1Hindol3yl)(4(thiophen2ylmethyl)piperazin1yl)aceticacid
1144459915
2(6(benzyloxy)1Hindol3yl)2(4(thiophen2ylmethyl)piperazin1yl)aceticacid
2(6phenylmethoxy1Hindol3yl)2(4(thiophen2ylmethyl)piperazin1yl)aceticacid
C1CN(CCN1CC2=CC=CS2)C(C3=CNC4=C3C=CC(=C4)OCC5=CC=CC=C5)C(=O)O
InChI=1SC26H27N3O3Sc3026(31)25(29121028(111329)172174143321)231627241520(8922(23)24)3218195213619h1914162527H10131718H2(H3031)
MFCD12216465
OC(=O)C(c1c(nH)c2c1ccc(c2)OCc1ccccc1)N1CCN(CC1)Cc1cccs1
ZINC000032101101
ZINC000032101104
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