Vitas-M small molecule compound
1-(benzylsulfanyl)-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
STL237258
SMILES CC(C1OCc2c(C1)c1c(s2)n2c(SCc3ccccc3)nnc2n(c1=O)CCc1ccccc1)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 C28H28N4O2S2 MW 516.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N4O2S2/c1-18(2)22-15-21-23(16-34-22)36-26-24(21)25(33)31(14-13-19-9-5-3-6-10-19)27-29-30-28(32(26)27)35-17-20-11-7-4-8-12-20/h3-12,18,22H,13-17H2,1-2H3InChIKey
UURHKJLZDXNMJE-UHFFFAOYSA-NSynonyms
487025-12-71(benzylsulfanyl)4(2phenylethyl)7(propan2yl)69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1(benzylthio)7isopropyl4phenethyl67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
487025127
CC(C)C1CC2=C(CO1)SC3=C2C(=O)N(C4=NN=C(N34)SCC5=CC=CC=C5)CCC6=CC=CC=C6
InChI=1SC28H28N4O2S2c118(2)22152123(163422)362624(21)25(33)31(14131995361019)27293028(32(26)27)351720117481220h3121822H1317H212H3
MFCD03286675
ZINC000001826342
ZINC000001826343
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