Vitas-M small molecule compound

(10E)-7-(2,5-dimethoxyphenyl)-10-(3-hydroxybenzylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one

Catalog ID
STL071459
SMILES COc1ccc(c(c1)C1C2=C(N=c3n1c(=O)/c(=C\c1cccc(c1)O)/s3)c1c(CC2)cccc1)OC

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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 C29H24N2O4S MW 496.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N2O4S/c1-34-20-11-13-24(35-2)23(16-20)27-22-12-10-18-7-3-4-9-21(18)26(22)30-29-31(27)28(33)25(36-29)15-17-6-5-8-19(32)14-17/h3-9,11,13-16,27,32H,10,12H2,1-2H3/b25-15+
InChIKey
CLHCQUDCQDMFRG-MFKUBSTISA-N
Synonyms

(10E)7(25dimethoxyphenyl)10(3hydroxybenzylidene)57dihydro6Hbenzo(h)(13)thiazolo(23b)quinazolin9(10H)one
(Z)7(25dimethoxyphenyl)10(3hydroxybenzylidene)710dihydro5Hbenzo(h)thiazolo(23b)quinazolin9(6H)one
7(25DIMETHOXYPHENYL)10(3HYDROXYBENZYLIDENE)57DIHYDRO6HBENZO(H)(13)THIAZOLO(23B)QUINAZOLIN9(10H)ONE
COC1=CC(=C(C=C1)OC)C2C3=C(C4=CC=CC=C4CC3)N=C5N2C(=O)C(=CC6=CC(=CC=C6)O)S5
COc1ccc(c(c1)C1C2=C(N=c3n1c(=O)c(=Cc1cccc(c1)O)s3)c1c(CC2)cccc1)OC
InChI=1SC29H24N2O4Sc13420111324(352)23(1620)2722121018734921(18)26(22)302931(27)28(33)25(3629)151765819(32)1417h391113162732H1012H212H3b2515+
MFCD02784544
ZINC000008437195
ZINC000008437200

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Available files

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