Vitas-M small molecule compound
1-[(3-methylbutyl)sulfanyl]-4-(4-methylphenyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK699017
SMILES CC(CCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)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/c1-14(2)12-13-29-23-25-24-22-26(16-10-8-15(3)9-11-16)20(28)19-17-6-4-5-7-18(17)30-21(19)27(22)23/h8-11,14H,4-7,12-13H2,1-3H3InChIKey
DBCGGEKDSAJCRY-UHFFFAOYSA-NSynonyms
372089-40-21((3methylbutyl)sulfanyl)4(4methylphenyl)6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1(isopentylthio)4(ptolyl)6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
372089402
CC1=CC=C(C=C1)N2C(=O)C3=C(N4C2=NN=C4SCCC(C)C)SC5=C3CCCC5
InChI=1SC23H26N4OS2c114(2)1213292325242226(1610815(3)91116)20(28)1917645718(17)3021(19)27(22)23h81114H471213H213H3
MFCD01877560
ZINC000002272641
ZINC02272641
ZINC2272641
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