Vitas-M small molecule compound
2-[(4-methoxybenzyl)sulfanyl]-3-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK698921
SMILES C=CCn1c(SCc2ccc(cc2)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/c1-3-12-23-20(24)18-16-6-4-5-7-17(16)27-19(18)22-21(23)26-13-14-8-10-15(25-2)11-9-14/h3,8-11H,1,4-7,12-13H2,2H3InChIKey
WUMWAZDIQQHIFR-UHFFFAOYSA-NSynonyms
351008-17-82((4methoxybenzyl)sulfanyl)3(prop2en1yl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2((4methoxyphenyl)methylsulfanyl)3prop2enyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
351008178
3allyl2((4methoxybenzyl)thio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
COC1=CC=C(C=C1)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2CC=C
InChI=1SC21H22N2O2S2c13122320(24)1816645717(16)2719(18)2221(23)26131481015(252)11914h3811H1471213H22H3
MFCD01852561
ZINC000000731756
ZINC00731756
ZINC731756
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