Vitas-M small molecule compound
3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-7-methyl-2-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK799350
SMILES CCC(N1C(=S)S/C(=C\c2c(NC3CC(C)(C)NC(C3)(C)C)nc3n(c2=O)cc(cc3)C)/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 C26H35N5O2S2 MW 513.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H35N5O2S2/c1-8-16(3)31-23(33)19(35-24(31)34)11-18-21(27-17-12-25(4,5)29-26(6,7)13-17)28-20-10-9-15(2)14-30(20)22(18)32/h9-11,14,16-17,27,29H,8,12-13H2,1-7H3/b19-11-InChIKey
BJIJDJKUTPXOAM-ODLFYWEKSA-NSynonyms
(5Z)3butan2yl5((7methyl4oxo2((2266tetramethylpiperidin4yl)amino)pyrido(12a)pyrimidin3yl)methylidene)2sulfanylidene13thiazolidin4one
3((Z)(3(butan2yl)4oxo2thioxo13thiazolidin5ylidene)methyl)7methyl2((2266tetramethylpiperidin4yl)amino)4Hpyrido(12a)pyrimidin4one
CCC(C)N1C(=O)C(=CC2=C(N=C3C=CC(=CN3C2=O)C)NC4CC(NC(C4)(C)C)(C)C)SC1=S
CCC(N1C(=S)SC(=Cc2c(NC3CC(C)(C)NC(C3)(C)C)nc3n(c2=O)cc(cc3)C)C1=O)C
InChI=1SC26H35N5O2S2c1816(3)3123(33)19(3524(31)34)111821(27171225(45)2926(67)1317)282010915(2)1430(20)22(18)32h9111416172729H81213H217H3b1911
MFCD03462395
ZINC000002672065
ZINC000002672067
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