Vitas-M small molecule compound
2-(4-benzylpiperazin-1-yl)-9-methyl-3-{(Z)-[4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK794427
SMILES S=C1S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)Cc2ccccc2)/C(=O)N1CCc1ccccc1
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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 C32H31N5O2S2 MW 581.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31N5O2S2/c1-23-9-8-15-36-28(23)33-29(35-19-17-34(18-20-35)22-25-12-6-3-7-13-25)26(30(36)38)21-27-31(39)37(32(40)41-27)16-14-24-10-4-2-5-11-24/h2-13,15,21H,14,16-20,22H2,1H3/b27-21-InChIKey
ZPIRIFNAVGCWNI-MEFGMAGPSA-NSynonyms
361994-00-5(5Z)5((2(4benzylpiperazin1yl)9methyl4oxopyrido(12a)pyrimidin3yl)methylidene)3(2phenylethyl)2sulfanylidene13thiazolidin4one
(5Z)5((2(4BENZYLPIPERAZIN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PHENETHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(4benzylpiperazin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3phenethyl2thioxothiazolidin4one
2(4benzylpiperazin1yl)9methyl3((Z)(4oxo3(2phenylethyl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
361994005
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4)N5CCN(CC5)CC6=CC=CC=C6
InChI=1SC32H31N5O2S2c12398153628(23)3329(35191734(182035)2225126371325)26(30(36)38)212731(39)37(32(40)4127)161424104251124h2131521H14162022H21H3b2721
MFCD01960076
S=C1SC(=Cc2c(nc3n(c2=O)cccc3C)N2CCN(CC2)Cc2ccccc2)C(=O)N1CCc1ccccc1
ZINC000100642356
ZINC100642356
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