Vitas-M small molecule compound
2-{[3-(1H-imidazol-1-yl)propyl]amino}-3-{(Z)-[3-(2-methoxyethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK876674
SMILES COCCN1C(=S)S/C(=C\c2c(NCCCn3cncc3)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 C21H22N6O3S2 MW 470.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N6O3S2/c1-30-12-11-27-20(29)16(32-21(27)31)13-15-18(23-6-4-8-25-10-7-22-14-25)24-17-5-2-3-9-26(17)19(15)28/h2-3,5,7,9-10,13-14,23H,4,6,8,11-12H2,1H3/b16-13-InChIKey
ZABFFOCILKIKTF-SSZFMOIBSA-NSynonyms
431995-14-1(5Z)5((2(3IMIDAZOL1YLPROPYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(2METHOXYETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2((3(1Himidazol1yl)propyl)amino)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3(2methoxyethyl)2thioxothiazolidin4one
2((3(1Himidazol1yl)propyl)amino)3((Z)(3(2methoxyethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
431995141
COCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)NCCCN4C=CN=C4)SC1=S
COCCN1C(=S)SC(=Cc2c(NCCCn3cncc3)nc3n(c2=O)cccc3)C1=O
InChI=1SC21H22N6O3S2c13012112720(29)16(3221(27)31)131518(2364825107221425)2417523926(17)19(15)28h2357910131423H4681112H21H3b1613
MFCD03141413
ZINC000008858086
ZINC8858086
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