Vitas-M small molecule compound
2-(4-tert-butylphenoxy)-3-{(Z)-[4-oxo-2-(piperidin-1-yl)-1,3-thiazol-5(4H)-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK705799
SMILES O=C1N=C(S/C/1=C\c1c(Oc2ccc(cc2)C(C)(C)C)nc2n(c1=O)cccc2)N1CCCCC1
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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 C27H28N4O3S MW 488.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O3S/c1-27(2,3)18-10-12-19(13-11-18)34-24-20(25(33)31-16-8-5-9-22(31)28-24)17-21-23(32)29-26(35-21)30-14-6-4-7-15-30/h5,8-13,16-17H,4,6-7,14-15H2,1-3H3/b21-17-InChIKey
OABQCKYCBVHYDP-FXBPSFAMSA-NSynonyms
(5Z)5((2(4TERTBUTYLPHENOXY)4OXO4HPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2(PIPERIDIN1YL)45DIHYDRO13THIAZOL4ONE
(5Z)5((2(4tertbutylphenoxy)4oxopyrido(12a)pyrimidin3yl)methylidene)2piperidin1yl13thiazol4one
2(4tertbutylphenoxy)3((Z)(4oxo2(piperidin1yl)13thiazol5(4H)ylidene)methyl)4Hpyrido(12a)pyrimidin4one
CC(C)(C)C1=CC=C(C=C1)OC2=C(C(=O)N3C=CC=CC3=N2)C=C4C(=O)N=C(S4)N5CCCCC5
InChI=1SC27H28N4O3Sc127(23)18101219(131118)342420(25(33)311685922(31)2824)172123(32)2926(3521)30146471530h58131617H4671415H213H3b2117
MFCD06642780
O=C1N=C(SC1=Cc1c(Oc2ccc(cc2)C(C)(C)C)nc2n(c1=O)cccc2)N1CCCCC1
ZINC000016734876
ZINC16734876
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