Vitas-M small molecule compound
3-(benzylsulfanyl)-11-propyl-7,8,9,10-tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Catalog ID
STK721439
SMILES CCCc1nc2sc3c(c2c2c1CCCC2)ncn1c3nnc1SCc1ccccc1
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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 C24H23N5S2 MW 445.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N5S2/c1-2-8-18-16-11-6-7-12-17(16)19-20-21(31-23(19)26-18)22-27-28-24(29(22)14-25-20)30-13-15-9-4-3-5-10-15/h3-5,9-10,14H,2,6-8,11-13H2,1H3InChIKey
KTBUFOSXVOELIC-UHFFFAOYSA-NSynonyms
487033-68-13(benzylsulfanyl)11propyl78910tetrahydro(124)triazolo(4316)pyrimido(4545)thieno(23c)isoquinoline
3(benzylthio)11propyl78910tetrahydro(124)triazolo(4316)pyrimido(4545)thieno(23c)isoquinoline
487033681
CCCC1=C2CCCCC2=C3C4=C(C5=NN=C(N5C=N4)SCC6=CC=CC=C6)SC3=N1
InChI=1SC24H23N5S2c128181611671217(16)192021(3123(19)2618)22272824(29(22)142520)30131594351015h3591014H2681113H21H3
MFCD03287135
ZINC000009008560
ZINC09008560
ZINC9008560
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