Vitas-M small molecule compound
4-methyl-1-[(2-oxo-2-phenylethyl)sulfanyl]-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK524463
SMILES O=C(c1ccccc1)CSc1nnc2n1c1sc3c(c1c(=O)n2C)CCCC3
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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 C20H18N4O2S2 MW 410.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O2S2/c1-23-17(26)16-13-9-5-6-10-15(13)28-18(16)24-19(23)21-22-20(24)27-11-14(25)12-7-3-2-4-8-12/h2-4,7-8H,5-6,9-11H2,1H3InChIKey
YMFVVUVMAWDXMF-UHFFFAOYSA-NSynonyms
374101-62-9374101629
4methyl1((2oxo2phenylethyl)sulfanyl)6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
4methyl1((2oxo2phenylethyl)thio)6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CN1C(=O)C2=C(N3C1=NN=C3SCC(=O)C4=CC=CC=C4)SC5=C2CCCC5
InChI=1SC20H18N4O2S2c12317(26)16139561015(13)2818(16)2419(23)212220(24)271114(25)127324812h2478H56911H21H3
MFCD01953096
ZINC000002286271
ZINC02286271
ZINC2286271
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