Vitas-M small molecule compound
3-[(Z)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[(3-hydroxypropyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK876377
SMILES OCCCNc1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccccc1
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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 C22H20N4O3S2 MW 452.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O3S2/c27-12-6-10-23-19-16(20(28)25-11-5-4-9-18(25)24-19)13-17-21(29)26(22(30)31-17)14-15-7-2-1-3-8-15/h1-5,7-9,11,13,23,27H,6,10,12,14H2/b17-13-InChIKey
UEQWMBKMVHQILD-LGMDPLHJSA-NSynonyms
(5Z)3BENZYL5((2(3HYDROXYPROPYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3benzyl5((2((3hydroxypropyl)amino)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3benzyl4oxo2thioxo13thiazolidin5ylidene)methyl)2((3hydroxypropyl)amino)4Hpyrido(12a)pyrimidin4one
C1=CC=C(C=C1)CN2C(=O)C(=CC3=C(N=C4C=CC=CN4C3=O)NCCCO)SC2=S
InChI=1SC22H20N4O3S2c2712610231916(20(28)251154918(25)2419)131721(29)26(22(30)3117)14157213815h157911132327H6101214H2b1713
MFCD02996893
OCCCNc1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)Cc1ccccc1
ZINC000001839525
ZINC1839525
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