Vitas-M small molecule compound
2-amino-4-(4-ethylphenyl)-6-(4-fluorobenzyl)-4,6-dihydropyrano[3,2-c][2,1]benzothiazine-3-carbonitrile 5,5-dioxide
Catalog ID
STL081727
SMILES CCc1ccc(cc1)C1C(=C(N)OC2=C1S(=O)(=O)N(c1c2cccc1)Cc1ccc(cc1)F)C#N
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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 C27H22FN3O3S MW 487.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22FN3O3S/c1-2-17-7-11-19(12-8-17)24-22(15-29)27(30)34-25-21-5-3-4-6-23(21)31(35(32,33)26(24)25)16-18-9-13-20(28)14-10-18/h3-14,24H,2,16,30H2,1H3InChIKey
WNDZPJGSLFFJME-UHFFFAOYSA-NSynonyms
2amino4(4ethylphenyl)6((4fluorophenyl)methyl)55dioxo4Hpyrano(32c)(21)benzothiazine3carbonitrile
2amino4(4ethylphenyl)6(4fluorobenzyl)46dihydropyrano(32c)(21)benzothiazine3carbonitrile55dioxide
CCC1=CC=C(C=C1)C2C(=C(OC3=C2S(=O)(=O)N(C4=CC=CC=C43)CC5=CC=C(C=C5)F)N)C#N
InChI=1SC27H22FN3O3Sc121771119(12817)2422(1529)27(30)342521534623(21)31(35(3233)26(24)25)161891320(28)141018h31424H21630H21H3
MFCD14914443
ZINC000020558487
ZINC000020558489
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