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]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK707215
SMILES CCCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)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 C28H30N4O2S2 MW 518.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4O2S2/c1-3-4-5-8-14-32-27(34)23(36-28(32)35)17-22-25(29-24-19(2)10-9-15-31(24)26(22)33)30-16-13-20-11-6-7-12-21(20)18-30/h6-7,9-12,15,17H,3-5,8,13-14,16,18H2,1-2H3/b23-17-InChIKey
XAGHMPPYUFFFTB-QJOMJCCJSA-NSynonyms
840479-36-9(5Z)5((2(34DIHYDRO1HISOQUINOLIN2YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3HEXYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(34dihydroisoquinolin2(1H)yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3hexyl2thioxothiazolidin4one
2(34dihydroisoquinolin2(1H)yl)3((Z)(3hexyl4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl4Hpyrido(12a)pyrimidin4one
840479369
CCCCCCN1C(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)N4CCC5=CC=CC=C5C4)SC1=S
CCCCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3C)N2CCc3c(C2)cccc3)C1=O
InChI=1SC28H30N4O2S2c13458143227(34)23(3628(32)35)172225(292419(2)1091531(24)26(22)33)3016132011671221(20)1830h679121517H35813141618H212H3b2317
MFCD04006610
ZINC000002263763
ZINC2263763
Check stock
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Check stock on Vitas-MAvailable files
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