Vitas-M small molecule compound
2-amino-6-(3-methylbenzyl)-4-(3,4,5-trimethoxyphenyl)-4,6-dihydropyrano[3,2-c][2,1]benzothiazine-3-carbonitrile 5,5-dioxide
Catalog ID
STL141770
SMILES N#CC1=C(N)OC2=C(C1c1cc(OC)c(c(c1)OC)OC)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 C29H27N3O6S MW 545.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N3O6S/c1-17-8-7-9-18(12-17)16-32-22-11-6-5-10-20(22)26-28(39(32,33)34)25(21(15-30)29(31)38-26)19-13-23(35-2)27(37-4)24(14-19)36-3/h5-14,25H,16,31H2,1-4H3InChIKey
DKLWLAOKWBJOHM-UHFFFAOYSA-NSynonyms
893298-11-82amino6((3methylphenyl)methyl)55dioxo4(345trimethoxyphenyl)4Hpyrano(32c)(21)benzothiazine3carbonitrile
2AMINO6(3METHYLBENZYL)4(345TRIMETHOXYPHENYL)46DIHYDROBENZO(C)PYRANO(23E)(12)THIAZINE3CARBONITRILE55DIOXIDE
2amino6(3methylbenzyl)4(345trimethoxyphenyl)46dihydropyrano(32c)(21)benzothiazine3carbonitrile55dioxide
893298118
CC1=CC(=CC=C1)CN2C3=CC=CC=C3C4=C(S2(=O)=O)C(C(=C(O4)N)C#N)C5=CC(=C(C(=C5)OC)OC)OC
InChI=1SC29H27N3O6Sc11787918(1217)16322211651020(22)2628(39(3233)34)25(21(1530)29(31)3826)191323(352)27(374)24(1419)363h51425H1631H214H3
MFCD14914499
ZINC000100032559
ZINC000100032562
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