Vitas-M small molecule compound
2-[cyclohexyl(methyl)amino]-3-{(Z)-[4-oxo-3-(1-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK797157
SMILES S=C1S/C(=C\c2c(nc3n(c2=O)cccc3)N(C2CCCCC2)C)/C(=O)N1C(c1ccccc1)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 C27H28N4O2S2 MW 504.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O2S2/c1-18(19-11-5-3-6-12-19)31-26(33)22(35-27(31)34)17-21-24(29(2)20-13-7-4-8-14-20)28-23-15-9-10-16-30(23)25(21)32/h3,5-6,9-12,15-18,20H,4,7-8,13-14H2,1-2H3/b22-17-InChIKey
CICWXAMPHCXIRT-XLNRJJMWSA-NSynonyms
(5Z)5((2(CYCLOHEXYL(METHYL)AMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(1PHENYLETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
2(cyclohexyl(methyl)amino)3((Z)(4oxo3(1phenylethyl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
CC(C1=CC=CC=C1)N2C(=O)C(=CC3=C(N=C4C=CC=CN4C3=O)N(C)C5CCCCC5)SC2=S
InChI=1SC27H28N4O2S2c118(19115361219)3126(33)22(3527(31)34)172124(29(2)20137481420)2823159101630(23)25(21)32h356912151820H4781314H212H3b2217
MFCD03225870
S=C1SC(=Cc2c(nc3n(c2=O)cccc3)N(C2CCCCC2)C)C(=O)N1C(c1ccccc1)C
ZINC000016699754
ZINC000016699756
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