Vitas-M small molecule compound
7-methyl-2-[(4-methylbenzyl)amino]-3-{(Z)-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK705200
SMILES Cc1ccc2n(c1)c(=O)c(c(n2)NCc1ccc(cc1)C)/C=C/1\SC(=S)N(C1=O)CC1CCCO1
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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/c1-16-5-8-18(9-6-16)13-27-23-20(24(31)29-14-17(2)7-10-22(29)28-23)12-21-25(32)30(26(34)35-21)15-19-4-3-11-33-19/h5-10,12,14,19,27H,3-4,11,13,15H2,1-2H3/b21-12-InChIKey
JTOWINQKZXSGJS-MTJSOVHGSA-NSynonyms
(5Z)5((7methyl2((4methylphenyl)methylamino)4oxopyrido(12a)pyrimidin3yl)methylidene)3(oxolan2ylmethyl)2sulfanylidene13thiazolidin4one
7methyl2((4methylbenzyl)amino)3((Z)(4oxo3(tetrahydrofuran2ylmethyl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
CC1=CC=C(C=C1)CNC2=C(C(=O)N3C=C(C=CC3=N2)C)C=C4C(=O)N(C(=S)S4)CC5CCCO5
InChI=1SC26H26N4O3S2c1165818(9616)13272320(24(31)291417(2)71022(29)2823)122125(32)30(26(34)3521)151943113319h51012141927H34111315H212H3b2112
MFCD03212723
ZINC000016734686
ZINC000016734689
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