Vitas-M small molecule compound
3-(3-acetyl-1H-indol-1-yl)-1-[4-(1,1-dioxidotetrahydrothiophen-3-yl)piperazin-1-yl]propan-1-one
Catalog ID
STL243517
SMILES O=C(N1CCN(CC1)C1CCS(=O)(=O)C1)CCn1cc(c2c1cccc2)C(=O)C
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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 C21H27N3O4S MW 417.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O4S/c1-16(25)19-14-24(20-5-3-2-4-18(19)20)8-6-21(26)23-11-9-22(10-12-23)17-7-13-29(27,28)15-17/h2-5,14,17H,6-13,15H2,1H3InChIKey
LONULGUHMGQCQC-UHFFFAOYSA-NSynonyms
1374530-99-01374530990
3(3acetyl1Hindol1yl)1(4(11dioxidotetrahydrothiophen3yl)piperazin1yl)propan1one
3(3acetylindol1yl)1(4(11dioxothiolan3yl)piperazin1yl)propan1one
CC(=O)C1=CN(C2=CC=CC=C21)CCC(=O)N3CCN(CC3)C4CCS(=O)(=O)C4
InChI=1SC21H27N3O4Sc116(25)191424(20532418(19)20)8621(26)2311922(101223)1771329(2728)1517h251417H61315H21H3
MFCD22203210
ZINC000072404697
ZINC000072404698
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