Vitas-M small molecule compound
3-{(Z)-[3-(3-methoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-7-methyl-2-(4-phenylpiperazin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK586738
SMILES COCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2)/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 C27H29N5O3S2 MW 535.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O3S2/c1-19-9-10-23-28-24(30-14-12-29(13-15-30)20-7-4-3-5-8-20)21(25(33)32(23)18-19)17-22-26(34)31(27(36)37-22)11-6-16-35-2/h3-5,7-10,17-18H,6,11-16H2,1-2H3/b22-17-InChIKey
NMJATGQEJXRFGD-XLNRJJMWSA-NSynonyms
638133-97-8(5Z)3(3METHOXYPROPYL)5((7METHYL4OXO2(4PHENYLPIPERAZIN1YL)PYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(3methoxypropyl)5((7methyl4oxo2(4phenylpiperazin1yl)4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(3methoxypropyl)4oxo2thioxo13thiazolidin5ylidene)methyl)7methyl2(4phenylpiperazin1yl)4Hpyrido(12a)pyrimidin4one
3(3METHOXYPROPYL)5((7METHYL4OXO2(4PHENYLPIPERAZINYL)(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)2THIOXO13THIAZOLIDIN4ONE
638133978
CC1=CN2C(=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCCOC)N4CCN(CC4)C5=CC=CC=C5)C=C1
COCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2)C1=O
InChI=1SC27H29N5O3S2c119910232824(30141229(131530)207435820)21(25(33)32(23)1819)172226(34)31(27(36)3722)11616352h357101718H61116H212H3b2217
MFCD03667568
ZINC000100870526
ZINC100870526
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