Vitas-M small molecule compound
3-{(Z)-[3-(4-methylbenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(prop-2-en-1-ylamino)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK823722
SMILES C=CCNc1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc(cc1)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 C23H20N4O2S2 MW 448.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O2S2/c1-3-11-24-20-17(21(28)26-12-5-4-6-19(26)25-20)13-18-22(29)27(23(30)31-18)14-16-9-7-15(2)8-10-16/h3-10,12-13,24H,1,11,14H2,2H3/b18-13-InChIKey
KQVACBOHSWFYCH-AQTBWJFISA-NSynonyms
(5Z)3((4METHYLPHENYL)METHYL)5((4OXO2(PROP2ENYLAMINO)PYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
3((Z)(3(4methylbenzyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(prop2en1ylamino)4Hpyrido(12a)pyrimidin4one
C=CCNc1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)Cc1ccc(cc1)C
CC1=CC=C(C=C1)CN2C(=O)C(=CC3=C(N=C4C=CC=CN4C3=O)NCC=C)SC2=S
InChI=1SC23H20N4O2S2c1311242017(21(28)261254619(26)2520)131822(29)27(23(30)3118)14169715(2)81016h310121324H11114H22H3b1813
MFCD03212966
ZINC000027020828
ZINC27020828
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