Vitas-M small molecule compound
2-[(2-chlorobenzyl)sulfanyl]-3-(4-ethoxyphenyl)-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK720606
SMILES CCOc1ccc(cc1)n1c(SCc2ccccc2Cl)nc2c(c1=O)c1CC(C)(C)OCc1s2
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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 C26H25ClN2O3S2 MW 513.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN2O3S2/c1-4-31-18-11-9-17(10-12-18)29-24(30)22-19-13-26(2,3)32-14-21(19)34-23(22)28-25(29)33-15-16-7-5-6-8-20(16)27/h5-12H,4,13-15H2,1-3H3InChIKey
KUAGQFCOZDJMHL-UHFFFAOYSA-NSynonyms
585558-11-82((2chlorobenzyl)sulfanyl)3(4ethoxyphenyl)66dimethyl3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
2((2chlorobenzyl)thio)3(4ethoxyphenyl)66dimethyl56dihydro3Hpyrano(4345)thieno(23d)pyrimidin4(8H)one
2((2chlorophenyl)methylsulfanyl)3(4ethoxyphenyl)66dimethyl58dihydropyrano(23)thieno(24b)pyrimidin4one
585558118
CCOC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC4=CC=CC=C4Cl)SC5=C3CC(OC5)(C)C
InChI=1SC26H25ClN2O3S2c14311811917(101218)2924(30)22191326(23)321421(19)3423(22)2825(29)331516756820(16)27h512H41315H213H3
MFCD04030584
ZINC000002393394
ZINC02393394
ZINC2393394
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