Vitas-M small molecule compound

3-(4-ethoxyphenyl)-6,6-dimethyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one

Catalog ID
STK720617
SMILES CCOc1ccc(cc1)n1c(SCC(=O)c2ccccc2)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 C27H26N2O4S2 MW 506.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O4S2/c1-4-32-19-12-10-18(11-13-19)29-25(31)23-20-14-27(2,3)33-15-22(20)35-24(23)28-26(29)34-16-21(30)17-8-6-5-7-9-17/h5-13H,4,14-16H2,1-3H3
InChIKey
QZSOELVAPHFJHJ-UHFFFAOYSA-N
Synonyms
579446-63-2
3(4ethoxyphenyl)66dimethyl2((2oxo2phenylethyl)sulfanyl)3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
3(4ethoxyphenyl)66dimethyl2((2oxo2phenylethyl)thio)56dihydro3Hpyrano(4345)thieno(23d)pyrimidin4(8H)one
3(4ethoxyphenyl)66dimethyl2phenacylsulfanyl58dihydropyrano(23)thieno(24b)pyrimidin4one
579446632
CCOC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)C4=CC=CC=C4)SC5=C3CC(OC5)(C)C
InChI=1SC27H26N2O4S2c143219121018(111319)2925(31)23201427(23)331522(20)3524(23)2826(29)341621(30)178657917h513H41416H213H3
MFCD04034481
ZINC000002399510
ZINC02399510
ZINC2399510

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Available files

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