Vitas-M small molecule compound
2-(3,4-dihydroisoquinolin-2(1H)-yl)-3-[(Z)-(3-hexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK707181
SMILES CCCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCc3c(C2)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 C27H28N4O2S2 MW 504.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O2S2/c1-2-3-4-8-15-31-26(33)22(35-27(31)34)17-21-24(28-23-12-7-9-14-30(23)25(21)32)29-16-13-19-10-5-6-11-20(19)18-29/h5-7,9-12,14,17H,2-4,8,13,15-16,18H2,1H3/b22-17-InChIKey
YXPJFMLPGOIILA-XLNRJJMWSA-NSynonyms
573935-46-3(5Z)5((2(34DIHYDRO1HISOQUINOLIN2YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3HEXYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(34dihydroisoquinolin2(1H)yl)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3hexyl2thioxothiazolidin4one
2(34dihydroisoquinolin2(1H)yl)3((Z)(3hexyl4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
573935463
CCCCCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCC5=CC=CC=C5C4)SC1=S
CCCCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCc3c(C2)cccc3)C1=O
InChI=1SC27H28N4O2S2c12348153126(33)22(3527(31)34)172124(282312791430(23)25(21)32)2916131910561120(19)1829h579121417H24813151618H21H3b2217
MFCD04020021
ZINC000002207169
ZINC2207169
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