Vitas-M small molecule compound
3-{(Z)-[3-(4-methylbenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-[(tetrahydrofuran-2-ylmethyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK811232
SMILES Cc1ccc(cc1)CN1C(=S)S/C(=C\c2c(NCC3CCCO3)nc3n(c2=O)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 C25H24N4O3S2 MW 492.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O3S2/c1-16-7-9-17(10-8-16)15-29-24(31)20(34-25(29)33)13-19-22(26-14-18-5-4-12-32-18)27-21-6-2-3-11-28(21)23(19)30/h2-3,6-11,13,18,26H,4-5,12,14-15H2,1H3/b20-13-InChIKey
ZQEYVSXAZWPDTE-MOSHPQCFSA-NSynonyms
(5Z)3((4METHYLPHENYL)METHYL)5((4OXO2(OXOLAN2YLMETHYLAMINO)PYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
3((Z)(3(4methylbenzyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2((tetrahydrofuran2ylmethyl)amino)4Hpyrido(12a)pyrimidin4one
CC1=CC=C(C=C1)CN2C(=O)C(=CC3=C(N=C4C=CC=CN4C3=O)NCC5CCCO5)SC2=S
Cc1ccc(cc1)CN1C(=S)SC(=Cc2c(NCC3CCCO3)nc3n(c2=O)cccc3)C1=O
InChI=1SC25H24N4O3S2c1167917(10816)152924(31)20(3425(29)33)131922(26141854123218)27216231128(21)23(19)30h23611131826H45121415H21H3b2013
MFCD03212970
ZINC000016713591
ZINC000016713593
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