Vitas-M small molecule compound

2-(3,4-dihydroisoquinolin-2(1H)-yl)-3-{(Z)-[3-(3-methoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK707205
SMILES COCCCN1C(=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 C26H26N4O3S2 MW 506.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O3S2/c1-17-7-5-11-29-22(17)27-23(28-13-10-18-8-3-4-9-19(18)16-28)20(24(29)31)15-21-25(32)30(26(34)35-21)12-6-14-33-2/h3-5,7-9,11,15H,6,10,12-14,16H2,1-2H3/b21-15-
InChIKey
CWMWXNHXPLMHKA-QNGOZBTKSA-N
Synonyms
579446-10-9
(5Z)5((2(34DIHYDRO1HISOQUINOLIN2YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(3METHOXYPROPYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(34dihydroisoquinolin2(1H)yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3(3methoxypropyl)2thioxothiazolidin4one
2(34dihydroisoquinolin2(1H)yl)3((Z)(3(3methoxypropyl)4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl4Hpyrido(12a)pyrimidin4one
579446109
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCCOC)N4CCC5=CC=CC=C5C4
COCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3C)N2CCc3c(C2)cccc3)C1=O
InChI=1SC26H26N4O3S2c11775112922(17)2723(28131018834919(18)1628)20(24(29)31)152125(32)30(26(34)3521)12614332h35791115H610121416H212H3b2115
MFCD04034430
ZINC000002399444
ZINC2399444

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Available files

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