Vitas-M small molecule compound
(2E,9E)-9-[4-(dimethylamino)benzylidene]-5-[4-(dimethylamino)phenyl]-2-(4-methoxybenzylidene)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazolin-3(2H)-one
Catalog ID
STL115174
SMILES COc1ccc(cc1)/C=c\1/sc2=NC3=C(C(n2c1=O)c1ccc(cc1)N(C)C)CCC/C/3=C\c1ccc(cc1)N(C)C
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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 C35H36N4O2S MW 576.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H36N4O2S/c1-37(2)27-15-9-23(10-16-27)21-26-7-6-8-30-32(26)36-35-39(33(30)25-13-17-28(18-14-25)38(3)4)34(40)31(42-35)22-24-11-19-29(41-5)20-12-24/h9-22,33H,6-8H2,1-5H3/b26-21+,31-22+InChIKey
GXOAWPXEZVILEW-AOHCEHPPSA-NSynonyms
(2E9E)5(4(dimethylamino)phenyl)9((4(dimethylamino)phenyl)methylidene)2((4methoxyphenyl)methylidene)5678tetrahydro(13)thiazolo(23b)quinazolin3one
(2E9E)9(4(dimethylamino)benzylidene)5(4(dimethylamino)phenyl)2(4methoxybenzylidene)6789tetrahydro5H(13)thiazolo(23b)quinazolin3(2H)one
CN(C)C1=CC=C(C=C1)C=C2CCCC3=C2N=C4N(C3C5=CC=C(C=C5)N(C)C)C(=O)C(=CC6=CC=C(C=C6)OC)S4
COc1ccc(cc1)C=c1sc2=NC3=C(C(n2c1=O)c1ccc(cc1)N(C)C)CCCC3=Cc1ccc(cc1)N(C)C
InChI=1SC35H36N4O2Sc137(2)2715923(101627)21267683032(26)363539(33(30)25131728(181425)38(3)4)34(40)31(4235)2224111929(415)201224h92233H68H215H3b2621+3122+
MFCD03177129
ZINC000097970857
ZINC000097970858
Check stock
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Check stock on Vitas-MAvailable files
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