Vitas-M small molecule compound
2-amino-4-(3-hydroxyphenyl)-6-(2-methylbenzyl)-4,6-dihydropyrano[3,2-c][2,1]benzothiazine-3-carbonitrile 5,5-dioxide
Catalog ID
STL081766
SMILES N#CC1=C(N)OC2=C(C1c1cccc(c1)O)S(=O)(=O)N(c1c2cccc1)Cc1ccccc1C
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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 C26H21N3O4S MW 471.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N3O4S/c1-16-7-2-3-8-18(16)15-29-22-12-5-4-11-20(22)24-25(34(29,31)32)23(21(14-27)26(28)33-24)17-9-6-10-19(30)13-17/h2-13,23,30H,15,28H2,1H3InChIKey
FJBUNXRRQSRUEQ-UHFFFAOYSA-NSynonyms
893300-34-02amino4(3hydroxyphenyl)6((2methylphenyl)methyl)55dioxo4Hpyrano(32c)(21)benzothiazine3carbonitrile
2AMINO4(3HYDROXYPHENYL)6(2METHYLBENZYL)46DIHYDROBENZO(C)PYRANO(23E)(12)THIAZINE3CARBONITRILE55DIOXIDE
2amino4(3hydroxyphenyl)6(2methylbenzyl)46dihydropyrano(32c)(21)benzothiazine3carbonitrile55dioxide
893300340
CC1=CC=CC=C1CN2C3=CC=CC=C3C4=C(S2(=O)=O)C(C(=C(O4)N)C#N)C5=CC(=CC=C5)O
InChI=1SC26H21N3O4Sc116723818(16)15292212541120(22)2425(34(2931)32)23(21(1427)26(28)3324)17961019(30)1317h2132330H1528H21H3
MFCD14914528
ZINC000020558713
ZINC000020558715
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