Vitas-M small molecule compound

2-[(3-methoxybenzyl)sulfanyl]-3-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one

Catalog ID
STL341553
SMILES C=CCn1c(SCc2cccc(c2)OC)nc2c(c1=O)c1CCCCc1s2

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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 C21H22N2O2S2 MW 398.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O2S2/c1-3-11-23-20(24)18-16-9-4-5-10-17(16)27-19(18)22-21(23)26-13-14-7-6-8-15(12-14)25-2/h3,6-8,12H,1,4-5,9-11,13H2,2H3
InChIKey
UUHBOWHQGNMRFM-UHFFFAOYSA-N
Synonyms
585555-03-9
2((3methoxybenzyl)sulfanyl)3(prop2en1yl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2((3methoxyphenyl)methylsulfanyl)3prop2enyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
3allyl2((3methoxybenzyl)thio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
585555039
COC1=CC=CC(=C1)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2CC=C
InChI=1SC21H22N2O2S2c13112320(24)18169451017(16)2719(18)2221(23)26131476815(1214)252h36812H14591113H22H3
MFCD04028239
ZINC000000731750
ZINC00731750
ZINC731750

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Available files

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