Vitas-M small molecule compound
(5-methyl-1H-indol-3-yl)[4-(phenylsulfonyl)piperazin-1-yl]acetic acid
Catalog ID
STK647058
SMILES OC(=O)C(c1c[nH]c2c1cc(C)cc2)N1CCN(CC1)S(=O)(=O)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 C21H23N3O4S MW 413.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O4S/c1-15-7-8-19-17(13-15)18(14-22-19)20(21(25)26)23-9-11-24(12-10-23)29(27,28)16-5-3-2-4-6-16/h2-8,13-14,20,22H,9-12H2,1H3,(H,25,26)InChIKey
QHZIQLASQXOJFM-UHFFFAOYSA-NSynonyms
1081127-43-6(5methyl1Hindol3yl)(4(phenylsulfonyl)piperazin1yl)aceticacid
1081127436
2(4(benzenesulfonyl)piperazin1yl)2(5methyl1Hindol3yl)aceticacid
2(5methyl1Hindol3yl)2(4(phenylsulfonyl)piperazin1yl)aceticacid
CC1=CC2=C(C=C1)NC=C2C(C(=O)O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4
InChI=1SC21H23N3O4Sc115781917(1315)18(142219)20(21(25)26)2391124(121023)29(2728)165324616h2813142022H912H21H3(H2526)
MFCD12206625
OC(=O)C(c1c(nH)c2c1cc(C)cc2)N1CCN(CC1)S(=O)(=O)c1ccccc1
ZINC000020722747
ZINC000020722749
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