Vitas-M small molecule compound
6-(4-nitrophenyl)-6,12-dihydro-5H-benzo[b]indeno[1,2-e][1,4]thiazepin-5-one 7,7-dioxide
Catalog ID
STK066699
SMILES [O-][N+](=O)c1ccc(cc1)C1C2=C(Nc3c(S1(=O)=O)cccc3)c1c(C2=O)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 C22H14N2O5S MW 418.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14N2O5S/c25-21-16-6-2-1-5-15(16)20-19(21)22(13-9-11-14(12-10-13)24(26)27)30(28,29)18-8-4-3-7-17(18)23-20/h1-12,22-23HInChIKey
LJYYHZMACCBZER-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1)C1C2=C(Nc3c(S1(=O)=O)cccc3)c1c(C2=O)cccc1
11(4nitrophenyl)1010dioxo511dihydroindeno(21c)(15)benzothiazepin12one
6(4NITROPHENYL)612DIHYDRO5HBENZO(B)INDENO(12E)(14)THIAZEPIN5ONE77DIOXIDE
C1=CC=C2C(=C1)C3=C(C2=O)C(S(=O)(=O)C4=CC=CC=C4N3)C5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC22H14N2O5Sc252116621515(16)2019(21)22(1391114(121013)24(26)27)30(2829)18843717(18)2320h1122223H
MFCD03011164
STK066699
ZINC000009553937
ZINC000009553938
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