Vitas-M small molecule compound
3-(1,3-benzodioxol-5-ylmethyl)-2-{[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}quinazolin-4(3H)-one
Catalog ID
STL108255
SMILES CCC1CCCCN1C(=O)CSc1nc2ccccc2c(=O)n1Cc1ccc2c(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 C25H27N3O4S MW 465.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O4S/c1-2-18-7-5-6-12-27(18)23(29)15-33-25-26-20-9-4-3-8-19(20)24(30)28(25)14-17-10-11-21-22(13-17)32-16-31-21/h3-4,8-11,13,18H,2,5-7,12,14-16H2,1H3InChIKey
KFOSTKYROHHHNT-UHFFFAOYSA-NSynonyms
3(13benzodioxol5ylmethyl)2((2(2ethylpiperidin1yl)2oxoethyl)sulfanyl)quinazolin4(3H)one
3(13benzodioxol5ylmethyl)2(2(2ethylpiperidin1yl)2oxoethyl)sulfanylquinazolin4one
CCC1CCCCN1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC5=C(C=C4)OCO5
InChI=1SC25H27N3O4Sc12187561227(18)23(29)1533252620943819(20)24(30)28(25)141710112122(1317)32163121h348111318H257121416H21H3
MFCD20742756
ZINC000067291015
ZINC000067291022
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