Vitas-M small molecule compound
(10Z)-7-(3,4-dimethoxyphenyl)-10-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Catalog ID
STK667088
SMILES COc1ccc(cc1OC)C1C2=C(N=c3n1c(=O)/c(=C/c1cc(n(c1C)c1ccc(cc1)F)C)/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 C35H30FN3O3S MW 591.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H30FN3O3S/c1-20-17-24(21(2)38(20)26-13-11-25(36)12-14-26)19-31-34(40)39-33(23-10-16-29(41-3)30(18-23)42-4)28-15-9-22-7-5-6-8-27(22)32(28)37-35(39)43-31/h5-8,10-14,16-19,33H,9,15H2,1-4H3/b31-19-InChIKey
YQYLKUUAIPGFOY-DXJNIWACSA-NSynonyms
(10Z)7(34DIMETHOXYPHENYL)10((1(4FLUOROPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)57DIHYDRO6HBENZO(H)(13)THIAZOLO(23B)QUINAZOLIN9(10H)ONE
(Z)7(34dimethoxyphenyl)10((1(4fluorophenyl)25dimethyl1Hpyrrol3yl)methylene)710dihydro5Hbenzo(h)thiazolo(23b)quinazolin9(6H)one
CC1=CC(=C(N1C2=CC=C(C=C2)F)C)C=C3C(=O)N4C(C5=C(C6=CC=CC=C6CC5)N=C4S3)C7=CC(=C(C=C7)OC)OC
COc1ccc(cc1OC)C1C2=C(N=c3n1c(=O)c(=Cc1cc(n(c1C)c1ccc(cc1)F)C)s3)c1c(CC2)cccc1
InChI=1SC35H30FN3O3Sc1201724(21(2)38(20)26131125(36)121426)193134(40)3933(23101629(413)30(1823)424)2815922756827(22)32(28)3735(39)4331h581014161933H915H214H3b3119
MFCD03662568
ZINC000001850541
ZINC000001850549
Check stock
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Check stock on Vitas-MAvailable files
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