Vitas-M small molecule compound
(5-methoxy-1H-indol-3-yl)[4-(methylsulfonyl)piperazin-1-yl]acetic acid
Catalog ID
STK654159
SMILES COc1ccc2c(c1)c(c[nH]2)C(N1CCN(CC1)S(=O)(=O)C)C(=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 C16H21N3O5S MW 367.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N3O5S/c1-24-11-3-4-14-12(9-11)13(10-17-14)15(16(20)21)18-5-7-19(8-6-18)25(2,22)23/h3-4,9-10,15,17H,5-8H2,1-2H3,(H,20,21)InChIKey
VGLDTPYRBTXAOV-UHFFFAOYSA-NSynonyms
1144437-99-9(5methoxy1Hindol3yl)(4(methylsulfonyl)piperazin1yl)aceticacid
1144437999
2(5methoxy1Hindol3yl)2(4(methylsulfonyl)piperazin1yl)aceticacid
2(5methoxy1Hindol3yl)2(4methylsulfonylpiperazin1yl)aceticacid
COC1=CC2=C(C=C1)NC=C2C(C(=O)O)N3CCN(CC3)S(=O)(=O)C
COc1ccc2c(c1)c(c(nH)2)C(N1CCN(CC1)S(=O)(=O)C)C(=O)O
InChI=1SC16H21N3O5Sc12411341412(911)13(101714)15(16(20)21)185719(8618)25(222)23h349101517H58H212H3(H2021)
MFCD12211612
ZINC000032072641
ZINC000032072643
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