Vitas-M small molecule compound
4-[({[4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]benzamide
Catalog ID
STL342007
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)N)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 C22H22N4O3S2 MW 454.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O3S2/c1-2-11-26-21(29)18-15-5-3-4-6-16(15)31-20(18)25-22(26)30-12-17(27)24-14-9-7-13(8-10-14)19(23)28/h2,7-10H,1,3-6,11-12H2,(H2,23,28)(H,24,27)InChIKey
XAGMGFTWTYBBMJ-UHFFFAOYSA-NSynonyms
578735-91-84((((4oxo3(prop2en1yl)345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetyl)amino)benzamide
4((2((4oxo3prop2enyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetyl)amino)benzamide
4(2((3allyl4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetamido)benzamide
578735918
C=CCN1C(=O)C2=C(N=C1SCC(=O)NC3=CC=C(C=C3)C(=O)N)SC4=C2CCCC4
InChI=1SC22H22N4O3S2c12112621(29)1815534616(15)3120(18)2522(26)301217(27)24149713(81014)19(23)28h2710H1361112H2(H22328)(H2427)
MFCD04031780
ZINC000002394746
ZINC02394746
ZINC2394746
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