Vitas-M small molecule compound
(2E,9E)-9-(2-chlorobenzylidene)-5-(2-chlorophenyl)-2-(2-fluorobenzylidene)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazolin-3(2H)-one
Catalog ID
STL115159
SMILES Fc1ccccc1/C=c\1/sc2=NC3=C(C(n2c1=O)c1ccccc1Cl)CCC/C/3=C\c1ccccc1Cl
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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 C30H21Cl2FN2OS MW 547.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H21Cl2FN2OS/c31-23-13-4-1-8-18(23)16-20-10-7-12-22-27(20)34-30-35(28(22)21-11-3-5-14-24(21)32)29(36)26(37-30)17-19-9-2-6-15-25(19)33/h1-6,8-9,11,13-17,28H,7,10,12H2/b20-16+,26-17+InChIKey
DXUQNVPBTQGZAH-SFHXXFADSA-NSynonyms
(2E9E)5(2chlorophenyl)9((2chlorophenyl)methylidene)2((2fluorophenyl)methylidene)5678tetrahydro(13)thiazolo(23b)quinazolin3one
(2E9E)9(2chlorobenzylidene)5(2chlorophenyl)2(2fluorobenzylidene)6789tetrahydro5H(13)thiazolo(23b)quinazolin3(2H)one
C1CC(=CC2=CC=CC=C2Cl)C3=C(C1)C(N4C(=O)C(=CC5=CC=CC=C5F)SC4=N3)C6=CC=CC=C6Cl
Fc1ccccc1C=c1sc2=NC3=C(C(n2c1=O)c1ccccc1Cl)CCCC3=Cc1ccccc1Cl
InChI=1SC30H21Cl2FN2OSc31231341818(23)1620107122227(20)343035(28(22)2111351424(21)32)29(36)26(3730)17199261525(19)33h168911131728H71012H2b2016+2617+
MFCD03177113
ZINC000096022384
ZINC000097970838
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