Vitas-M small molecule compound
3-{(Z)-[3-(2-methoxyethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-[4-(4-methoxyphenyl)piperazin-1-yl]-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK703034
SMILES COCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccc(cc2)OC)/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 C27H29N5O4S2 MW 551.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O4S2/c1-18-4-9-23-28-24(30-12-10-29(11-13-30)19-5-7-20(36-3)8-6-19)21(25(33)32(23)17-18)16-22-26(34)31(14-15-35-2)27(37)38-22/h4-9,16-17H,10-15H2,1-3H3/b22-16-InChIKey
NNRHGCKKLATGHX-JWGURIENSA-NSynonyms
(5Z)3(2METHOXYETHYL)5((2(4(4METHOXYPHENYL)PIPERAZIN1YL)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(2methoxyethyl)5((2(4(4methoxyphenyl)piperazin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(2methoxyethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(4(4methoxyphenyl)piperazin1yl)7methyl4Hpyrido(12a)pyrimidin4one
CC1=CN2C(=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCOC)N4CCN(CC4)C5=CC=C(C=C5)OC)C=C1
COCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccc(cc2)OC)C1=O
InChI=1SC27H29N5O4S2c11849232824(30121029(111330)195720(363)8619)21(25(33)32(23)1718)162226(34)31(1415352)27(37)3822h491617H1015H213H3b2216
MFCD03009384
ZINC000100762481
ZINC100762481
Check stock
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Check stock on Vitas-MAvailable files
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