Vitas-M small molecule compound
2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-3-(pyridin-3-ylmethyl)quinazolin-4(3H)-one
Catalog ID
STL106123
SMILES O=c1c2ccccc2nc(n1Cc1cccnc1)SCc1ccc2c(c1)OCO2
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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 C22H17N3O3S MW 403.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O3S/c26-21-17-5-1-2-6-18(17)24-22(25(21)12-16-4-3-9-23-11-16)29-13-15-7-8-19-20(10-15)28-14-27-19/h1-11H,12-14H2InChIKey
XFEOTVMVUZDDAN-UHFFFAOYSA-NSynonyms
2((13benzodioxol5ylmethyl)sulfanyl)3(pyridin3ylmethyl)quinazolin4(3H)one
2(13benzodioxol5ylmethylsulfanyl)3(pyridin3ylmethyl)quinazolin4one
C1OC2=C(O1)C=C(C=C2)CSC3=NC4=CC=CC=C4C(=O)N3CC5=CN=CC=C5
InChI=1SC22H17N3O3Sc262117512618(17)2422(25(21)1216439231116)291315781920(1015)28142719h111H1214H2
MFCD20737513
ZINC000067258383
ZINC67258383
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