Vitas-M small molecule compound

methyl {[4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate

Catalog ID
STK831143
SMILES C=CCn1c(SCC(=O)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 C16H18N2O3S2 MW 350.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O3S2/c1-3-8-18-15(20)13-10-6-4-5-7-11(10)23-14(13)17-16(18)22-9-12(19)21-2/h3H,1,4-9H2,2H3
InChIKey
ZSJKWULIGYQLGQ-UHFFFAOYSA-N
Synonyms
42062-95-3
42062953
COC(=O)CSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1CC=C
InChI=1SC16H18N2O3S2c1381815(20)1310645711(10)2314(13)1716(18)22912(19)212h3H149H22H3
methyl((4oxo3(prop2en1yl)345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetate
methyl2((3allyl4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetate
methyl2((4oxo3prop2enyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetate
MFCD01044509
ZINC000000728147
ZINC00728147
ZINC728147

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Available files

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