Vitas-M small molecule compound
2-(4-tert-butylphenoxy)-3-{(Z)-[3-(2-methoxyethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK905080
SMILES COCCN1C(=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 C25H25N3O4S2 MW 495.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O4S2/c1-25(2,3)16-8-10-17(11-9-16)32-21-18(22(29)27-12-6-5-7-20(27)26-21)15-19-23(30)28(13-14-31-4)24(33)34-19/h5-12,15H,13-14H2,1-4H3/b19-15-InChIKey
LQMUVMZDDPMMRJ-CYVLTUHYSA-NSynonyms
(5Z)5((2(4tertbutylphenoxy)4oxopyrido(12a)pyrimidin3yl)methylidene)3(2methoxyethyl)2sulfanylidene13thiazolidin4one
2(4tertbutylphenoxy)3((Z)(3(2methoxyethyl)4oxo2thioxo13thiazolidin5ylidene)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(=S)S4)CCOC
COCCN1C(=S)SC(=Cc2c(Oc3ccc(cc3)C(C)(C)C)nc3n(c2=O)cccc3)C1=O
InChI=1SC25H25N3O4S2c125(23)1681017(11916)322118(22(29)271265720(27)2621)151923(30)28(1314314)24(33)3419h51215H1314H214H3b1915
MFCD18076236
ZINC000040221203
ZINC40221203
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