Vitas-M small molecule compound
3-[(Z)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-(3,5-dimethylpiperidin-1-yl)-7-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK704310
SMILES CC1CC(C)CN(C1)c1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccccc1)C
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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 C27H28N4O2S2 MW 504.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O2S2/c1-17-9-10-23-28-24(29-13-18(2)11-19(3)14-29)21(25(32)30(23)15-17)12-22-26(33)31(27(34)35-22)16-20-7-5-4-6-8-20/h4-10,12,15,18-19H,11,13-14,16H2,1-3H3/b22-12-InChIKey
KIBFUFAIRDNYSA-UUYOSTAYSA-NSynonyms
(5Z)3BENZYL5((2(35DIMETHYLPIPERIDIN1YL)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(E)3benzyl5((2(35dimethylpiperidin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3benzyl4oxo2thioxo13thiazolidin5ylidene)methyl)2(35dimethylpiperidin1yl)7methyl4Hpyrido(12a)pyrimidin4one
CC1CC(C)CN(C1)c1nc2ccc(cn2c(=O)c1C=C1SC(=S)N(C1=O)Cc1ccccc1)C
CC1CC(CN(C1)C2=C(C(=O)N3C=C(C=CC3=N2)C)C=C4C(=O)N(C(=S)S4)CC5=CC=CC=C5)C
InChI=1SC27H28N4O2S2c117910232824(291318(2)1119(3)1429)21(25(32)30(23)1517)122226(33)31(27(34)3522)16207546820h41012151819H11131416H213H3b2212
MFCD06642740
ZINC000026533886
ZINC000026533900
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