Vitas-M small molecule compound
2-(cyclohexylamino)-3-{(Z)-[3-(furan-2-ylmethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK814775
SMILES S=C1S/C(=C\c2c(NC3CCCCC3)nc3n(c2=O)cccc3)/C(=O)N1Cc1ccco1
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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 C23H22N4O3S2 MW 466.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O3S2/c28-21-17(13-18-22(29)27(23(31)32-18)14-16-9-6-12-30-16)20(24-15-7-2-1-3-8-15)25-19-10-4-5-11-26(19)21/h4-6,9-13,15,24H,1-3,7-8,14H2/b18-13-InChIKey
SGDVVMYEUSECGP-AQTBWJFISA-NSynonyms
(5Z)5((2(CYCLOHEXYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(FURAN2YLMETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
2(cyclohexylamino)3((Z)(3(furan2ylmethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
C1CCC(CC1)NC2=C(C(=O)N3C=CC=CC3=N2)C=C4C(=O)N(C(=S)S4)CC5=CC=CO5
InChI=1SC23H22N4O3S2c282117(131822(29)27(23(31)3218)141696123016)20(24157213815)251910451126(19)21h469131524H137814H2b1813
MFCD05151869
S=C1SC(=Cc2c(NC3CCCCC3)nc3n(c2=O)cccc3)C(=O)N1Cc1ccco1
ZINC000016731680
ZINC16731680
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