Vitas-M small molecule compound
1-[(2-oxo-2-phenylethyl)sulfanyl]-4-(2-phenylethyl)-7-(propan-2-yl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK542951
SMILES CC(C1OCc2c(C1)c1c(=O)n(CCc3ccccc3)c3n(c1s2)c(SCC(=O)c1ccccc1)nn3)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 C29H28N4O3S2 MW 544.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N4O3S2/c1-18(2)23-15-21-24(16-36-23)38-27-25(21)26(35)32(14-13-19-9-5-3-6-10-19)28-30-31-29(33(27)28)37-17-22(34)20-11-7-4-8-12-20/h3-12,18,23H,13-17H2,1-2H3InChIKey
OTLCLFXJPIWYHW-UHFFFAOYSA-NSynonyms
497242-43-01((2oxo2phenylethyl)sulfanyl)4(2phenylethyl)7(propan2yl)69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
497242430
7isopropyl1((2oxo2phenylethyl)thio)4phenethyl67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
CC(C)C1CC2=C(CO1)SC3=C2C(=O)N(C4=NN=C(N34)SCC(=O)C5=CC=CC=C5)CCC6=CC=CC=C6
InChI=1SC29H28N4O3S2c118(2)23152124(163623)382725(21)26(35)32(14131995361019)28303129(33(27)28)371722(34)20117481220h3121823H1317H212H3
MFCD03300170
ZINC000001782821
ZINC000001782822
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