Vitas-M small molecule compound

2-{1-[4-(1,1-dioxidotetrahydrothiophen-3-yl)piperazin-1-yl]-1-oxopropan-2-yl}-2,3-dihydro-1H-isoindol-1-one

Catalog ID
STL251352
SMILES O=C(C(N1Cc2c(C1=O)cccc2)C)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/c1-14(22-12-15-4-2-3-5-17(15)19(22)24)18(23)21-9-7-20(8-10-21)16-6-11-27(25,26)13-16/h2-5,14,16H,6-13H2,1H3
InChIKey
REHJQCCFJKNWSU-UHFFFAOYSA-N
Synonyms

2((2S)1(4(11dioxidotetrahydrothiophen3yl)piperazin1yl)1oxopropan2yl)isoindolin1one
2(1(4(11dioxidotetrahydrothiophen3yl)piperazin1yl)1oxopropan2yl)23dihydro1Hisoindol1one
2(1(4(11dioxothiolan3yl)piperazin1yl)1oxopropan2yl)3Hisoindol1one
CC(C(=O)N1CCN(CC1)C2CCS(=O)(=O)C2)N3CC4=CC=CC=C4C3=O
InChI=1SC19H25N3O4Sc114(221215423517(15)19(22)24)18(23)219720(81021)1661127(2526)1316h251416H613H21H3
MFCD24852634
O=C((C@@H)(N1Cc2c(C1=O)cccc2)C)N1CCN(CC1)C1CCS(=O)(=O)C1
ZINC000072406451
ZINC000080337973

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Available files

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