Vitas-M small molecule compound
4-benzyl-8-tert-butyl-1-[(2-methylprop-2-en-1-yl)sulfanyl]-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK698867
SMILES CC(=C)CSc1nnc2n1c1sc3c(c1c(=O)n2Cc1ccccc1)CCC(C3)C(C)(C)C
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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 C26H30N4OS2 MW 478.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N4OS2/c1-16(2)15-32-25-28-27-24-29(14-17-9-7-6-8-10-17)22(31)21-19-12-11-18(26(3,4)5)13-20(19)33-23(21)30(24)25/h6-10,18H,1,11-15H2,2-5H3InChIKey
XZFVDWCTHXHUHA-UHFFFAOYSA-NSynonyms
372972-09-3372972093
4benzyl8(tertbutyl)1((2methylallyl)thio)6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
4benzyl8tertbutyl1((2methylprop2en1yl)sulfanyl)6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CC(=C)CSC1=NN=C2N1C3=C(C4=C(S3)CC(CC4)C(C)(C)C)C(=O)N2CC5=CC=CC=C5
InChI=1SC26H30N4OS2c116(2)15322528272429(141797681017)22(31)2119121118(26(34)5)1320(19)3323(21)30(24)25h61018H11115H225H3
MFCD01897882
ZINC000009335033
ZINC000009335034
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