Vitas-M small molecule compound
N-(4-methoxybenzyl)-3-{[4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}propanamide
Catalog ID
STK069618
SMILES C=CCn1c(SCCC(=O)NCc2ccc(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 C24H27N3O3S2 MW 469.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N3O3S2/c1-3-13-27-23(29)21-18-6-4-5-7-19(18)32-22(21)26-24(27)31-14-12-20(28)25-15-16-8-10-17(30-2)11-9-16/h3,8-11H,1,4-7,12-15H2,2H3,(H,25,28)InChIKey
WHIHIAIVGAHBCF-UHFFFAOYSA-NSynonyms
C=CCn1c(SCCC(=O)NCc2ccc(cc2)OC)nc2c(c1=O)c1CCCCc1s2
COC1=CC=C(C=C1)CNC(=O)CCSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2CC=C
InChI=1SC24H27N3O3S2c13132723(29)2118645719(18)3222(21)2624(27)31141220(28)25151681017(302)11916h3811H1471215H22H3(H2528)
MFCD01564874
N((4methoxyphenyl)methyl)3((4oxo3prop2enyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)propanamide
N(4methoxybenzyl)3((4oxo3(prop2en1yl)345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)propanamide
STK069618
ZINC000001276176
ZINC01276176
ZINC1276176
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