Vitas-M small molecule compound
2-amino-6-(3-methoxybenzyl)-4-(pyridin-3-yl)-4,6-dihydropyrano[3,2-c][2,1]benzothiazine-3-carbonitrile 5,5-dioxide
Catalog ID
STL081769
SMILES COc1cccc(c1)CN1c2ccccc2C2=C(S1(=O)=O)C(c1cccnc1)C(=C(O2)N)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 C25H20N4O4S MW 472.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N4O4S/c1-32-18-8-4-6-16(12-18)15-29-21-10-3-2-9-19(21)23-24(34(29,30)31)22(17-7-5-11-28-14-17)20(13-26)25(27)33-23/h2-12,14,22H,15,27H2,1H3InChIKey
XUHACHKJTDQVLK-UHFFFAOYSA-NSynonyms
893301-30-92amino6((3methoxyphenyl)methyl)55dioxo4pyridin3yl4Hpyrano(32c)(21)benzothiazine3carbonitrile
2AMINO6(3METHOXYBENZYL)4(PYRIDIN3YL)46DIHYDROBENZO(C)PYRANO(23E)(12)THIAZINE3CARBONITRILE55DIOXIDE
2amino6(3methoxybenzyl)4(pyridin3yl)46dihydropyrano(32c)(21)benzothiazine3carbonitrile55dioxide
2AMINO6(3METHOXYBENZYL)4PYRIDIN3YL46DIHYDROPYRANO(32C)(21)BENZOTHIAZINE3CARBONITRILE55DIOXIDE
893301309
COC1=CC=CC(=C1)CN2C3=CC=CC=C3C4=C(S2(=O)=O)C(C(=C(O4)N)C#N)C5=CN=CC=C5
InChI=1SC25H20N4O4Sc1321884616(1218)1529211032919(21)2324(34(2930)31)22(177511281417)20(1326)25(27)3323h2121422H1527H21H3
MFCD14914540
ZINC000020558741
ZINC000020558743
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