Vitas-M small molecule compound
7-ethyl-7-methyl-1-[(2-oxo-2-phenylethyl)sulfanyl]-4-phenyl-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
STK530886
SMILES CCC1(C)OCc2c(C1)c1c(s2)n2c(SCC(=O)c3ccccc3)nnc2n(c1=O)c1ccccc1
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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 C27H24N4O3S2 MW 516.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24N4O3S2/c1-3-27(2)14-19-21(15-34-27)36-24-22(19)23(33)30(18-12-8-5-9-13-18)25-28-29-26(31(24)25)35-16-20(32)17-10-6-4-7-11-17/h4-13H,3,14-16H2,1-2H3InChIKey
KAULNUMFJHYQHW-UHFFFAOYSA-NSynonyms
7ethyl7methyl1((2oxo2phenylethyl)sulfanyl)4phenyl69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
7ethyl7methyl1((2oxo2phenylethyl)thio)4phenyl67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
CCC1(CC2=C(CO1)SC3=C2C(=O)N(C4=NN=C(N34)SCC(=O)C5=CC=CC=C5)C6=CC=CC=C6)C
InChI=1SC27H24N4O3S2c1327(2)141921(153427)362422(19)23(33)30(18128591318)25282926(31(24)25)351620(32)17106471117h413H31416H212H3
MFCD02240532
ZINC000002297983
ZINC000002297984
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