Vitas-M small molecule compound

6-(4-tert-butylphenyl)-6,12-dihydro-5H-benzo[b]indeno[1,2-e][1,4]thiazepin-5-one 7,7-dioxide

Catalog ID
STL444778
SMILES O=C1c2ccccc2C2=C1C(c1ccc(cc1)C(C)(C)C)S(=O)(=O)c1c(N2)cccc1

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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 C26H23NO3S MW 429.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23NO3S/c1-26(2,3)17-14-12-16(13-15-17)25-22-23(18-8-4-5-9-19(18)24(22)28)27-20-10-6-7-11-21(20)31(25,29)30/h4-15,25,27H,1-3H3
InChIKey
PKOYRACQFYEDOR-UHFFFAOYSA-N
Synonyms
371124-31-1
(6S)6(4TERTBUTYLPHENYL)612DIHYDRO5HBENZO(B)INDENO(12E)(14)THIAZEPIN5ONE77DIOXIDE
11(4(tertbutyl)phenyl)5Hbenzo(b)indeno(12e)(14)thiazepin12(11H)one1010dioxide
11(4tertbutylphenyl)1010dioxo511dihydroindeno(21c)(15)benzothiazepin12one
371124311
6(4tertbutylphenyl)612dihydro5Hbenzo(b)indeno(12e)(14)thiazepin5one77dioxide
CC(C)(C)C1=CC=C(C=C1)C2C3=C(C4=CC=CC=C4C3=O)NC5=CC=CC=C5S2(=O)=O
InChI=1SC26H23NO3Sc126(23)17141216(131517)252223(18845919(18)24(22)28)272010671121(20)31(2529)30h4152527H13H3
MFCD03007865
ZINC000002420663
ZINC000002420664

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Available files

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