Vitas-M small molecule compound
6-benzyl-2-(pyridin-4-yl)-6,8,9,10-tetrahydro-5H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-one
Catalog ID
STK631407
SMILES O=c1n(Cc2ccccc2)c2sc3c(c2c2n1nc(n2)c1ccncc1)CCC3
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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 C22H17N5OS MW 399.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N5OS/c28-22-26(13-14-5-2-1-3-6-14)21-18(16-7-4-8-17(16)29-21)20-24-19(25-27(20)22)15-9-11-23-12-10-15/h1-3,5-6,9-12H,4,7-8,13H2InChIKey
IBITUDNOMMVYQM-UHFFFAOYSA-NSynonyms
951982-97-16benzyl2(pyridin4yl)68910tetrahydro5Hcyclopenta(45)thieno(32e)(124)triazolo(15c)pyrimidin5one
951982971
C1CC2=C(C1)SC3=C2C4=NC(=NN4C(=O)N3CC5=CC=CC=C5)C6=CC=NC=C6
InChI=1SC22H17N5OSc282226(13145213614)2118(1674817(16)2921)202419(2527(20)22)1591123121015h1356912H47813H2
MFCD09856926
ZINC000013728313
ZINC13728313
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