Vitas-M small molecule compound
[4-(1,1-dioxidotetrahydrothiophen-3-yl)piperazin-1-yl](2-methyl-1H-indol-3-yl)acetic acid
Catalog ID
STL239163
SMILES OC(=O)C(c1c(C)[nH]c2c1cccc2)N1CCN(CC1)C1CCS(=O)(=O)C1
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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 C19H25N3O4S MW 391.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25N3O4S/c1-13-17(15-4-2-3-5-16(15)20-13)18(19(23)24)22-9-7-21(8-10-22)14-6-11-27(25,26)12-14/h2-5,14,18,20H,6-12H2,1H3,(H,23,24)InChIKey
KIKRUYTUEYIBSP-UHFFFAOYSA-NSynonyms
1081140-43-3(4(11dioxidotetrahydrothiophen3yl)piperazin1yl)(2methyl1Hindol3yl)aceticacid
1081140433
2(4(11dioxidotetrahydrothiophen3yl)piperazin1yl)2(2methyl1Hindol3yl)aceticacid
2(4(11dioxothiolan3yl)piperazin1yl)2(2methyl1Hindol3yl)aceticacid
CC1=C(C2=CC=CC=C2N1)C(C(=O)O)N3CCN(CC3)C4CCS(=O)(=O)C4
InChI=1SC19H25N3O4Sc11317(15423516(15)2013)18(19(23)24)229721(81022)1461127(2526)1214h25141820H612H21H3(H2324)
MFCD12209594
OC(=O)C(c1c(C)(nH)c2c1cccc2)N1CCN(CC1)C1CCS(=O)(=O)C1
ZINC000020739978
ZINC000020739987
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