Vitas-M small molecule compound
6-chloro-N-(3,4-dimethoxybenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-4-oxo-4H-chromene-2-carboxamide
Catalog ID
STK911826
SMILES COc1cc(ccc1OC)CN(C(=O)c1cc(=O)c2c(o1)ccc(c2)Cl)C1CCS(=O)(=O)C1
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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 C23H22ClNO7S MW 491.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClNO7S/c1-30-20-5-3-14(9-21(20)31-2)12-25(16-7-8-33(28,29)13-16)23(27)22-11-18(26)17-10-15(24)4-6-19(17)32-22/h3-6,9-11,16H,7-8,12-13H2,1-2H3InChIKey
PNOQBPMRRNKYAQ-UHFFFAOYSA-NSynonyms
874138-81-56chloroN((34dimethoxyphenyl)methyl)N(11dioxothiolan3yl)4oxochromene2carboxamide
6chloroN(34dimethoxybenzyl)N(11dioxidotetrahydrothiophen3yl)4oxo4Hchromene2carboxamide
874138815
COC1=C(C=C(C=C1)CN(C2CCS(=O)(=O)C2)C(=O)C3=CC(=O)C4=C(O3)C=CC(=C4)Cl)OC
InChI=1SC23H22ClNO7Sc130205314(921(20)312)1225(167833(2829)1316)23(27)221118(26)171015(24)4619(17)3222h3691116H781213H212H3
MFCD07426766
ZINC000008916309
ZINC000008916315
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