Vitas-M small molecule compound

2-(4-tert-butylphenoxy)-3-[(Z)-(4-oxo-3-propyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK881395
SMILES CCCN1C(=S)S/C(=C\c2c(Oc3ccc(cc3)C(C)(C)C)nc3n(c2=O)cccc3)/C1=O

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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 C25H25N3O3S2 MW 479.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O3S2/c1-5-13-28-23(30)19(33-24(28)32)15-18-21(26-20-8-6-7-14-27(20)22(18)29)31-17-11-9-16(10-12-17)25(2,3)4/h6-12,14-15H,5,13H2,1-4H3/b19-15-
InChIKey
RDFINKYSXODUDW-CYVLTUHYSA-N
Synonyms
796880-94-9
(5Z)5((2(4TERTBUTYLPHENOXY)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PROPYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(4(tertbutyl)phenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3propyl2thioxothiazolidin4one
2(4tertbutylphenoxy)3((Z)(4oxo3propyl2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
2(4TERTBUTYLPHENOXY)3(4OXO3PROPYL2THIOXOTHIAZOLIDIN(5Z)YLIDENEMETHYL)PYRIDO(12A)PYRIMIDIN4ONE
796880949
CCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)OC4=CC=C(C=C4)C(C)(C)C)SC1=S
CCCN1C(=S)SC(=Cc2c(Oc3ccc(cc3)C(C)(C)C)nc3n(c2=O)cccc3)C1=O
InChI=1SC25H25N3O3S2c15132823(30)19(3324(28)32)151821(26208671427(20)22(18)29)311711916(101217)25(23)4h6121415H513H214H3b1915
MFCD03670360
ZINC000002201891
ZINC2201891

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Available files

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