Vitas-M small molecule compound
2-amino-4-(2-bromophenyl)-6-(4-fluorobenzyl)-4,6-dihydropyrano[3,2-c][2,1]benzothiazine-3-carbonitrile 5,5-dioxide
Catalog ID
STL141757
SMILES N#CC1=C(N)OC2=C(C1c1ccccc1Br)S(=O)(=O)N(c1c2cccc1)Cc1ccc(cc1)F
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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 C25H17BrFN3O3S MW 538.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17BrFN3O3S/c26-20-7-3-1-5-17(20)22-19(13-28)25(29)33-23-18-6-2-4-8-21(18)30(34(31,32)24(22)23)14-15-9-11-16(27)12-10-15/h1-12,22H,14,29H2InChIKey
VHMIBNVOFWGFOR-UHFFFAOYSA-NSynonyms
893294-10-52amino4(2bromophenyl)6((4fluorophenyl)methyl)55dioxo4Hpyrano(32c)(21)benzothiazine3carbonitrile
2AMINO4(2BROMOPHENYL)6(4FLUOROBENZYL)46DIHYDROBENZO(C)PYRANO(23E)(12)THIAZINE3CARBONITRILE55DIOXIDE
2amino4(2bromophenyl)6(4fluorobenzyl)46dihydropyrano(32c)(21)benzothiazine3carbonitrile55dioxide
893294105
C1=CC=C(C(=C1)C2C(=C(OC3=C2S(=O)(=O)N(C4=CC=CC=C43)CC5=CC=C(C=C5)F)N)C#N)Br
InChI=1SC25H17BrFN3O3Sc2620731517(20)2219(1328)25(29)332318624821(18)30(34(3132)24(22)23)141591116(27)121015h11222H1429H2
MFCD14914448
ZINC000100032461
ZINC000100032464
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