Vitas-M small molecule compound

(2E)-N-(3-bromobenzyl)-3-(4-tert-butylphenyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide

Catalog ID
STK581300
SMILES Brc1cccc(c1)CN(C1CCS(=O)(=O)C1)C(=O)/C=C/c1ccc(cc1)C(C)(C)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 C24H28BrNO3S MW 490.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28BrNO3S/c1-24(2,3)20-10-7-18(8-11-20)9-12-23(27)26(22-13-14-30(28,29)17-22)16-19-5-4-6-21(25)15-19/h4-12,15,22H,13-14,16-17H2,1-3H3/b12-9+
InChIKey
SGXGXZZSKDQGHI-FMIVXFBMSA-N
Synonyms
850900-70-8
(2E)N(3bromobenzyl)3(4tertbutylphenyl)N(11dioxidotetrahydrothiophen3yl)prop2enamide
(E)N((3BROMOPHENYL)METHYL)3(4TERTBUTYLPHENYL)N(11DIOXOTHIOLAN3YL)PROP2ENAMIDE
(E)N(3bromobenzyl)3(4(tertbutyl)phenyl)N(11dioxidotetrahydrothiophen3yl)acrylamide
850900708
Brc1cccc(c1)CN(C1CCS(=O)(=O)C1)C(=O)C=Cc1ccc(cc1)C(C)(C)C
CC(C)(C)C1=CC=C(C=C1)C=CC(=O)N(CC2=CC(=CC=C2)Br)C3CCS(=O)(=O)C3
InChI=1SC24H28BrNO3Sc124(23)2010718(81120)91223(27)26(22131430(2829)1722)161954621(25)1519h4121522H13141617H213H3b129+
MFCD05695909
ZINC000002449828
ZINC000009291674

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Available files

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