Vitas-M small molecule compound
3-[(4-methoxybenzyl)sulfanyl]-11-phenyl-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
STK935236
SMILES COc1ccc(cc1)CSc1nnc2n1cnc1c2sc2c1c1CCCCc1c(n2)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 C28H23N5OS2 MW 509.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23N5OS2/c1-34-19-13-11-17(12-14-19)15-35-28-32-31-26-25-24(29-16-33(26)28)22-20-9-5-6-10-21(20)23(30-27(22)36-25)18-7-3-2-4-8-18/h2-4,7-8,11-14,16H,5-6,9-10,15H2,1H3InChIKey
UAQAPWNUFQZWSD-UHFFFAOYSA-NSynonyms
671763-95-43((4methoxybenzyl)sulfanyl)11phenyl78910tetrahydro(124)triazolo(4316)pyrimido(4545)thieno(23c)isoquinoline
3((4methoxybenzyl)thio)11phenyl78910tetrahydro(124)triazolo(4316)pyrimido(4545)thieno(23c)isoquinoline
671763954
COC1=CC=C(C=C1)CSC2=NN=C3N2C=NC4=C3SC5=NC(=C6CCCCC6=C45)C7=CC=CC=C7
InChI=1SC28H23N5OS2c13419131117(121419)1535283231262524(291633(26)28)22209561021(20)23(3027(22)3625)187324818h2478111416H5691015H21H3
MFCD03794289
ZINC000009129178
ZINC09129178
ZINC9129178
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