Vitas-M small molecule compound

(2E)-N-(3-bromobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-3-(furan-2-yl)prop-2-enamide

Catalog ID
STK590500
SMILES Brc1cccc(c1)CN(C1CCS(=O)(=O)C1)C(=O)/C=C/c1ccco1

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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 C18H18BrNO4S MW 424.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18BrNO4S/c19-15-4-1-3-14(11-15)12-20(16-8-10-25(22,23)13-16)18(21)7-6-17-5-2-9-24-17/h1-7,9,11,16H,8,10,12-13H2/b7-6+
InChIKey
SUZNSWYXPAZGRN-VOTSOKGWSA-N
Synonyms
872455-61-3
(2E)N(3bromobenzyl)N(11dioxidotetrahydrothiophen3yl)3(furan2yl)prop2enamide
(E)N((3BROMOPHENYL)METHYL)N(11DIOXOTHIOLAN3YL)3(FURAN2YL)PROP2ENAMIDE
(E)N(3bromobenzyl)N(11dioxidotetrahydrothiophen3yl)3(furan2yl)acrylamide
(E)N(3BROMOBENZYL)N(11DIOXOTETRAHYDRO1LAMBDA6THIOPHEN3YL)3FURAN2YLACRYLAMIDE
872455613
Brc1cccc(c1)CN(C1CCS(=O)(=O)C1)C(=O)C=Cc1ccco1
C1CS(=O)(=O)CC1N(CC2=CC(=CC=C2)Br)C(=O)C=CC3=CC=CO3
InChI=1SC18H18BrNO4Sc191541314(1115)1220(1681025(2223)1316)18(21)76175292417h1791116H8101213H2b76+
MFCD05701869
ZINC000009223198
ZINC000009223199

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.