Vitas-M small molecule compound
2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-3-(3-ethoxypropyl)quinazolin-4(3H)-one
Catalog ID
STL106579
SMILES CCOCCCn1c(SCc2ccc3c(c2)OCO3)nc2c(c1=O)cccc2
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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 C21H22N2O4S MW 398.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O4S/c1-2-25-11-5-10-23-20(24)16-6-3-4-7-17(16)22-21(23)28-13-15-8-9-18-19(12-15)27-14-26-18/h3-4,6-9,12H,2,5,10-11,13-14H2,1H3InChIKey
DGYOWZZYFXAGDN-UHFFFAOYSA-NSynonyms
2((13benzodioxol5ylmethyl)sulfanyl)3(3ethoxypropyl)quinazolin4(3H)one
2(13BENZODIOXOL5YLMETHYLSULFANYL)3(3ETHOXYPROPYL)QUINAZOLIN4ONE
CCOCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC4=C(C=C3)OCO4
InChI=1SC21H22N2O4Sc1225115102320(24)16634717(16)2221(23)281315891819(1215)27142618h346912H2510111314H21H3
MFCD20737885
ZINC000005021578
ZINC5021578
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