Vitas-M small molecule compound
2-[(2-hydroxypropyl)amino]-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
STK800703
SMILES CC(CNc1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCc1ccccc1)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 C23H22N4O3S2 MW 466.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O3S2/c1-15(28)14-24-20-17(21(29)26-11-6-5-9-19(26)25-20)13-18-22(30)27(23(31)32-18)12-10-16-7-3-2-4-8-16/h2-9,11,13,15,24,28H,10,12,14H2,1H3/b18-13-InChIKey
BOWACKKTIDPYLS-AQTBWJFISA-NSynonyms
(5Z)5((2(2hydroxypropylamino)4oxopyrido(12a)pyrimidin3yl)methylidene)3(2phenylethyl)2sulfanylidene13thiazolidin4one
2((2hydroxypropyl)amino)3((Z)(4oxo3(2phenylethyl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
CC(CNC1=C(C(=O)N2C=CC=CC2=N1)C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4)O
CC(CNc1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)CCc1ccccc1)O
InChI=1SC23H22N4O3S2c115(28)14242017(21(29)261165919(26)2520)131822(30)27(23(31)3218)1210167324816h291113152428H101214H21H3b1813
MFCD04447168
ZINC000016735888
ZINC000016735891
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