Vitas-M small molecule compound

(2Z)-2-{5-chloro-2-[(4-fluorobenzyl)oxy]benzylidene}-5-(4-ethoxyphenyl)-7-methyl-3-oxo-N-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

Catalog ID
STK613659
SMILES CCOc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)/c(=C/c1cc(Cl)ccc1OCc1ccc(cc1)F)/s2)C(=O)Nc1ccccc1

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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 C36H29ClFN3O4S MW 654.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H29ClFN3O4S/c1-3-44-29-16-11-24(12-17-29)33-32(34(42)40-28-7-5-4-6-8-28)22(2)39-36-41(33)35(43)31(46-36)20-25-19-26(37)13-18-30(25)45-21-23-9-14-27(38)15-10-23/h4-20,33H,3,21H2,1-2H3,(H,40,42)/b31-20-
InChIKey
KTAZGPQWVCFTLB-GTWSWNCMSA-N
Synonyms
903188-84-1
(2Z)2((5chloro2((4fluorophenyl)methoxy)phenyl)methylidene)5(4ethoxyphenyl)7methyl3oxoNphenyl5H(13)thiazolo(32a)pyrimidine6carboxamide
(2Z)2(5chloro2((4fluorobenzyl)oxy)benzylidene)5(4ethoxyphenyl)7methyl3oxoNphenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxamide
(Z)2(5chloro2((4fluorobenzyl)oxy)benzylidene)5(4ethoxyphenyl)7methyl3oxoNphenyl35dihydro2Hthiazolo(32a)pyrimidine6carboxamide
903188841
CCOC1=CC=C(C=C1)C2C(=C(N=C3N2C(=O)C(=CC4=C(C=CC(=C4)Cl)OCC5=CC=C(C=C5)F)S3)C)C(=O)NC6=CC=CC=C6
CCOc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)c(=Cc1cc(Cl)ccc1OCc1ccc(cc1)F)s2)C(=O)Nc1ccccc1
InChI=1SC36H29ClFN3O4Sc134429161124(121729)3332(34(42)40287546828)22(2)393641(33)35(43)31(4636)20251926(37)131830(25)45212391427(38)151023h42033H321H212H3(H4042)b3120
MFCD08287164
ZINC000150395429
ZINC000150395431

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Available files

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