Vitas-M small molecule compound
1-(methylsulfanyl)-4-phenyl-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
STK532202
SMILES CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CC(OC3)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 C20H20N4O2S2 MW 412.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O2S2/c1-11(2)14-9-13-15(10-26-14)28-18-16(13)17(25)23(12-7-5-4-6-8-12)19-21-22-20(27-3)24(18)19/h4-8,11,14H,9-10H2,1-3H3InChIKey
HBPGQKOUMUCHCQ-UHFFFAOYSA-NSynonyms
1(methylsulfanyl)4phenyl7(propan2yl)69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
7isopropyl1(methylthio)4phenyl67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
CC(C)C1CC2=C(CO1)SC3=C2C(=O)N(C4=NN=C(N34)SC)C5=CC=CC=C5
InChI=1SC20H20N4O2S2c111(2)1491315(102614)281816(13)17(25)23(127546812)19212220(273)24(18)19h481114H910H213H3
MFCD02991655
ZINC000002279068
ZINC000002279069
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