Vitas-M small molecule compound
3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-{[3-(morpholin-4-yl)propyl]amino}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK800442
SMILES CCC(N1C(=S)S/C(=C\c2c(NCCCN3CCOCC3)nc3n(c2=O)cccc3)/C1=O)C
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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 C23H29N5O3S2 MW 487.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N5O3S2/c1-3-16(2)28-22(30)18(33-23(28)32)15-17-20(24-8-6-9-26-11-13-31-14-12-26)25-19-7-4-5-10-27(19)21(17)29/h4-5,7,10,15-16,24H,3,6,8-9,11-14H2,1-2H3/b18-15-InChIKey
POWCQYYTESIFGI-SDXDJHTJSA-NSynonyms
(5Z)3butan2yl5((2(3morpholin4ylpropylamino)4oxopyrido(12a)pyrimidin3yl)methylidene)2sulfanylidene13thiazolidin4one
3((Z)(3(butan2yl)4oxo2thioxo13thiazolidin5ylidene)methyl)2((3(morpholin4yl)propyl)amino)4Hpyrido(12a)pyrimidin4one
CCC(C)N1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)NCCCN4CCOCC4)SC1=S
CCC(N1C(=S)SC(=Cc2c(NCCCN3CCOCC3)nc3n(c2=O)cccc3)C1=O)C
InChI=1SC23H29N5O3S2c1316(2)2822(30)18(3323(28)32)151720(2486926111331141226)25197451027(19)21(17)29h45710151624H36891114H212H3b1815
MFCD04447112
ZINC000016735672
ZINC000016735675
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