Vitas-M small molecule compound
2-amino-4-(4-hydroxyphenyl)-6-(3-methylbenzyl)-4,6-dihydropyrano[3,2-c][2,1]benzothiazine-3-carbonitrile 5,5-dioxide
Catalog ID
STL081746
SMILES N#CC1=C(N)OC2=C(C1c1ccc(cc1)O)S(=O)(=O)N(c1c2cccc1)Cc1cccc(c1)C
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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/c1-16-5-4-6-17(13-16)15-29-22-8-3-2-7-20(22)24-25(34(29,31)32)23(21(14-27)26(28)33-24)18-9-11-19(30)12-10-18/h2-13,23,30H,15,28H2,1H3InChIKey
NQONRZDOKWHHKK-UHFFFAOYSA-NSynonyms
893297-48-82amino4(4hydroxyphenyl)6((3methylphenyl)methyl)55dioxo4Hpyrano(32c)(21)benzothiazine3carbonitrile
2AMINO4(4HYDROXYPHENYL)6(3METHYLBENZYL)46DIHYDROBENZO(C)PYRANO(23E)(12)THIAZINE3CARBONITRILE55DIOXIDE
2amino4(4hydroxyphenyl)6(3methylbenzyl)46dihydropyrano(32c)(21)benzothiazine3carbonitrile55dioxide
893297488
CC1=CC(=CC=C1)CN2C3=CC=CC=C3C4=C(S2(=O)=O)C(C(=C(O4)N)C#N)C5=CC=C(C=C5)O
InChI=1SC26H21N3O4Sc11654617(1316)152922832720(22)2425(34(2931)32)23(21(1427)26(28)3324)1891119(30)121018h2132330H1528H21H3
MFCD14914491
ZINC000020558618
ZINC000020558620
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