Vitas-M small molecule compound
3-{(Z)-[3-(2-methoxyethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-2-(4-methylpiperazin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK794449
SMILES COCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)C)/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 C21H25N5O3S2 MW 459.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O3S2/c1-14-5-4-6-25-17(14)22-18(24-9-7-23(2)8-10-24)15(19(25)27)13-16-20(28)26(11-12-29-3)21(30)31-16/h4-6,13H,7-12H2,1-3H3/b16-13-InChIKey
SJHWXHPOBCDURK-SSZFMOIBSA-NSynonyms
361996-80-7(5Z)3(2METHOXYETHYL)5((9METHYL2(4METHYLPIPERAZIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(2methoxyethyl)5((9methyl2(4methylpiperazin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(2methoxyethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl2(4methylpiperazin1yl)4Hpyrido(12a)pyrimidin4one
361996807
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCOC)N4CCN(CC4)C
COCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3C)N2CCN(CC2)C)C1=O
InChI=1SC21H25N5O3S2c1145462517(14)2218(249723(2)81024)15(19(25)27)131620(28)26(1112293)21(30)3116h4613H712H213H3b1613
MFCD01955337
ZINC000002388417
ZINC2388417
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