Vitas-M small molecule compound

3-[(Z)-(3-butyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-7-methyl-2-[(4-methylbenzyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK704773
SMILES CCCCN1C(=S)S/C(=C\c2c(NCc3ccc(cc3)C)nc3n(c2=O)cc(cc3)C)/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 C25H26N4O2S2 MW 478.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O2S2/c1-4-5-12-28-24(31)20(33-25(28)32)13-19-22(26-14-18-9-6-16(2)7-10-18)27-21-11-8-17(3)15-29(21)23(19)30/h6-11,13,15,26H,4-5,12,14H2,1-3H3/b20-13-
InChIKey
XTLYXTNGRNVAEK-MOSHPQCFSA-N
Synonyms

(5Z)3BUTYL5((7METHYL2((4METHYLPHENYL)METHYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
3((Z)(3butyl4oxo2thioxo13thiazolidin5ylidene)methyl)7methyl2((4methylbenzyl)amino)4Hpyrido(12a)pyrimidin4one
CCCCN1C(=O)C(=CC2=C(N=C3C=CC(=CN3C2=O)C)NCC4=CC=C(C=C4)C)SC1=S
CCCCN1C(=S)SC(=Cc2c(NCc3ccc(cc3)C)nc3n(c2=O)cc(cc3)C)C1=O
InChI=1SC25H26N4O2S2c145122824(31)20(3325(28)32)131922(2614189616(2)71018)272111817(3)1529(21)23(19)30h611131526H451214H213H3b2013
MFCD03212710
ZINC000016805827
ZINC16805827

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Available files

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