Vitas-M small molecule compound
9-(1,3-dithiolan-2-ylidene)-5-(4-methoxyphenyl)-6,7,8,9,10,10a-hexahydro-5H-[1,3]thiazolo[2,3-b]quinazolin-3(2H)-one
Catalog ID
STK993307
SMILES COc1ccc(cc1)C1N2C(=O)CSC2NC2=C1CCCC2=C1SCCS1
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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 C20H22N2O2S3 MW 418.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O2S3/c1-24-13-7-5-12(6-8-13)18-14-3-2-4-15(19-25-9-10-26-19)17(14)21-20-22(18)16(23)11-27-20/h5-8,18,20-21H,2-4,9-11H2,1H3InChIKey
MPQYIQDQLNTIGJ-UHFFFAOYSA-NSynonyms
9(13dithiolan2ylidene)5(4methoxyphenyl)56781010ahexahydro(13)thiazolo(23b)quinazolin3one
9(13dithiolan2ylidene)5(4methoxyphenyl)67891010ahexahydro5H(13)thiazolo(23b)quinazolin3(2H)one
COC1=CC=C(C=C1)C2C3=C(C(=C4SCCS4)CCC3)NC5N2C(=O)CS5
InChI=1SC20H22N2O2S3c124137512(6813)181432415(19259102619)17(14)212022(18)16(23)112720h58182021H24911H21H3
MFCD18184841
ZINC000102827862
ZINC000102827871
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