Vitas-M small molecule compound

8-bromo-N-(4-methylbenzyl)-2,3-dihydro-1H-pyrrolo[2,1-c][1,4]benzothiazine-4-carboxamide 5,5-dioxide

Catalog ID
STL096123
SMILES Cc1ccc(cc1)CNC(=O)C1=C2CCCN2c2c(S1(=O)=O)ccc(c2)Br

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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 C20H19BrN2O3S MW 447.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19BrN2O3S/c1-13-4-6-14(7-5-13)12-22-20(24)19-16-3-2-10-23(16)17-11-15(21)8-9-18(17)27(19,25)26/h4-9,11H,2-3,10,12H2,1H3,(H,22,24)
InChIKey
GVTLFMHCUNJAPM-UHFFFAOYSA-N
Synonyms
1291871-25-4
1291871254
8bromoN((4methylphenyl)methyl)55dioxo23dihydro1Hpyrrolo(21c)(14)benzothiazine4carboxamide
8bromoN(4methylbenzyl)23dihydro1Hpyrrolo(21c)(14)benzothiazine4carboxamide55dioxide
CC1=CC=C(C=C1)CNC(=O)C2=C3CCCN3C4=C(S2(=O)=O)C=CC(=C4)Br
InChI=1SC20H19BrN2O3Sc1134614(7513)122220(24)1916321023(16)171115(21)8918(17)27(1925)26h4911H231012H21H3(H2224)
MFCD18788389
ZINC000067244864
ZINC67244864

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Available files

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