Vitas-M small molecule compound
9-methyl-3-{(Z)-[4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(phenylsulfanyl)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STL234858
SMILES S=C1S/C(=C\c2c(Sc3ccccc3)nc3n(c2=O)cccc3C)/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 C27H21N3O2S3 MW 515.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N3O2S3/c1-18-9-8-15-29-23(18)28-24(34-20-12-6-3-7-13-20)21(25(29)31)17-22-26(32)30(27(33)35-22)16-14-19-10-4-2-5-11-19/h2-13,15,17H,14,16H2,1H3/b22-17-InChIKey
OWYPVMARRDHZBL-XLNRJJMWSA-NSynonyms
799773-29-8(5Z)5((9methyl4oxo2phenylsulfanylpyrido(12a)pyrimidin3yl)methylidene)3(2phenylethyl)2sulfanylidene13thiazolidin4one
(5Z)5((9METHYL4OXO2PHENYLSULFANYLPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PHENETHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((9methyl4oxo2(phenylthio)4Hpyrido(12a)pyrimidin3yl)methylene)3phenethyl2thioxothiazolidin4one
799773298
9methyl3((Z)(4oxo3(2phenylethyl)2thioxo13thiazolidin5ylidene)methyl)2(phenylsulfanyl)4Hpyrido(12a)pyrimidin4one
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4)SC5=CC=CC=C5
InChI=1SC27H21N3O2S3c11898152923(18)2824(3420126371320)21(25(29)31)172226(32)30(27(33)3522)161419104251119h2131517H1416H21H3b2217
MFCD03212869
S=C1SC(=Cc2c(Sc3ccccc3)nc3n(c2=O)cccc3C)C(=O)N1CCc1ccccc1
ZINC000002206805
ZINC2206805
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