Vitas-M small molecule compound
4-benzyl-1-[(3-methylbutyl)sulfanyl]-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STL296626
SMILES CC(CCSc1nnc2n1c1sc3c(c1c(=O)n2Cc1ccccc1)CCCC3)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 C23H26N4OS2 MW 438.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4OS2/c1-15(2)12-13-29-23-25-24-22-26(14-16-8-4-3-5-9-16)20(28)19-17-10-6-7-11-18(17)30-21(19)27(22)23/h3-5,8-9,15H,6-7,10-14H2,1-2H3InChIKey
AXBRHRAUXNLOMI-UHFFFAOYSA-NSynonyms
351898-26-5351898265
4benzyl1((3methylbutyl)sulfanyl)6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
4benzyl1(isopentylthio)6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CC(C)CCSC1=NN=C2N1C3=C(C4=C(S3)CCCC4)C(=O)N2CC5=CC=CC=C5
InChI=1SC23H26N4OS2c115(2)1213292325242226(14168435916)20(28)191710671118(17)3021(19)27(22)23h358915H671014H212H3
MFCD01561825
ZINC000002864608
ZINC02864608
ZINC2864608
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