Vitas-M small molecule compound
(10E)-7-(3-methoxyphenyl)-10-[2-(naphthalen-1-ylmethoxy)benzylidene]-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Catalog ID
STK325864
SMILES COc1cccc(c1)C1C2=C(N=c3n1c(=O)/c(=C\c1ccccc1OCc1cccc4c1cccc4)/s3)c1c(CC2)cccc1
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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 C39H30N2O3S MW 606.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H30N2O3S/c1-43-30-16-9-14-28(22-30)37-33-21-20-26-11-3-6-18-32(26)36(33)40-39-41(37)38(42)35(45-39)23-27-12-4-7-19-34(27)44-24-29-15-8-13-25-10-2-5-17-31(25)29/h2-19,22-23,37H,20-21,24H2,1H3/b35-23+InChIKey
BUOMRYWRBOKPLV-QCFMCPCVSA-NSynonyms
(10E)7(3methoxyphenyl)10(2(naphthalen1ylmethoxy)benzylidene)57dihydro6Hbenzo(h)(13)thiazolo(23b)quinazolin9(10H)one
(E)7(3methoxyphenyl)10(2(naphthalen1ylmethoxy)benzylidene)710dihydro5Hbenzo(h)thiazolo(23b)quinazolin9(6H)one
COC1=CC=CC(=C1)C2C3=C(C4=CC=CC=C4CC3)N=C5N2C(=O)C(=CC6=CC=CC=C6OCC7=CC=CC8=CC=CC=C87)S5
COc1cccc(c1)C1C2=C(N=c3n1c(=O)c(=Cc1ccccc1OCc1cccc4c1cccc4)s3)c1c(CC2)cccc1
InChI=1SC39H30N2O3Sc143301691428(2230)373321202611361832(26)36(33)403941(37)38(42)35(4539)232712471934(27)442429158132510251731(25)29h219222337H202124H21H3b3523+
MFCD03663454
ZINC000097962536
ZINC000097962537
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