Vitas-M small molecule compound
(10Z)-10-({2-[(4-bromobenzyl)oxy]naphthalen-1-yl}methylidene)-7-(2-chlorophenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Catalog ID
STK699294
SMILES Brc1ccc(cc1)COc1ccc2c(c1/C=c/1\sc3=NC4=C(C(n3c1=O)c1ccccc1Cl)CCc1c4cccc1)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 C38H26BrClN2O2S MW 690.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H26BrClN2O2S/c39-26-17-13-23(14-18-26)22-44-33-20-16-24-7-1-3-9-27(24)31(33)21-34-37(43)42-36(29-11-5-6-12-32(29)40)30-19-15-25-8-2-4-10-28(25)35(30)41-38(42)45-34/h1-14,16-18,20-21,36H,15,19,22H2/b34-21-InChIKey
KJUUVULWTGAGBG-ZXSNDDASSA-NSynonyms
(10Z)10((2((4bromobenzyl)oxy)naphthalen1yl)methylidene)7(2chlorophenyl)57dihydro6Hbenzo(h)(13)thiazolo(23b)quinazolin9(10H)one
(E)10((2((4bromobenzyl)oxy)naphthalen1yl)methylene)7(2chlorophenyl)710dihydro5Hbenzo(h)thiazolo(23b)quinazolin9(6H)one
Brc1ccc(cc1)COc1ccc2c(c1C=c1sc3=NC4=C(C(n3c1=O)c1ccccc1Cl)CCc1c4cccc1)cccc2
C1CC2=C(C3=CC=CC=C31)N=C4N(C2C5=CC=CC=C5Cl)C(=O)C(=CC6=C(C=CC7=CC=CC=C76)OCC8=CC=C(C=C8)Br)S4
InChI=1SC38H26BrClN2O2Sc3926171323(141826)224433201624713927(24)31(33)213437(43)4236(2911561232(29)40)301915258241028(25)35(30)4138(42)4534h1141618202136H151922H2b3421
MFCD02784095
ZINC000097968512
ZINC000097968513
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