Vitas-M small molecule compound
(2-methyl-1H-indol-3-yl)[4-(phenylsulfonyl)piperazin-1-yl]acetic acid
Catalog ID
STK646853
SMILES OC(=O)C(c1c(C)[nH]c2c1cccc2)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/c1-15-19(17-9-5-6-10-18(17)22-15)20(21(25)26)23-11-13-24(14-12-23)29(27,28)16-7-3-2-4-8-16/h2-10,20,22H,11-14H2,1H3,(H,25,26)InChIKey
PTOLDJBWOTVATC-UHFFFAOYSA-NSynonyms
1040708-92-6(2methyl1Hindol3yl)(4(phenylsulfonyl)piperazin1yl)aceticacid
1040708926
2(2methyl1Hindol3yl)2(4(phenylsulfonyl)piperazin1yl)aceticacid
2(4(benzenesulfonyl)piperazin1yl)2(2methyl1Hindol3yl)aceticacid
CC1=C(C2=CC=CC=C2N1)C(C(=O)O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4
InChI=1SC21H23N3O4Sc11519(179561018(17)2215)20(21(25)26)23111324(141223)29(2728)167324816h2102022H1114H21H3(H2526)
MFCD12206495
OC(=O)C(c1c(C)(nH)c2c1cccc2)N1CCN(CC1)S(=O)(=O)c1ccccc1
ZINC000020722169
ZINC000020722172
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