Vitas-M small molecule compound
2-[4-(4-fluorophenyl)piperazin-1-yl]-9-methyl-3-{(Z)-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK881599
SMILES Fc1ccc(cc1)N1CCN(CC1)c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CC1CCCO1
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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 C28H28FN5O3S2 MW 565.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28FN5O3S2/c1-18-4-2-10-33-24(18)30-25(32-13-11-31(12-14-32)20-8-6-19(29)7-9-20)22(26(33)35)16-23-27(36)34(28(38)39-23)17-21-5-3-15-37-21/h2,4,6-10,16,21H,3,5,11-15,17H2,1H3/b23-16-InChIKey
XFTWQPPSACJMKW-KQWNVCNZSA-NSynonyms
(5Z)5((2(4(4FLUOROPHENYL)PIPERAZIN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(OXOLAN2YLMETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(E)5((2(4(4fluorophenyl)piperazin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3((tetrahydrofuran2yl)methyl)2thioxothiazolidin4one
2(4(4fluorophenyl)piperazin1yl)9methyl3((Z)(4oxo3(tetrahydrofuran2ylmethyl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CC4CCCO4)N5CCN(CC5)C6=CC=C(C=C6)F
Fc1ccc(cc1)N1CCN(CC1)c1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)CC1CCCO1
InChI=1SC28H28FN5O3S2c11842103324(18)3025(32131131(121432)208619(29)7920)22(26(33)35)162327(36)34(28(38)3923)172153153721h246101621H35111517H21H3b2316
MFCD18075909
ZINC000097947266
ZINC000097947267
Check stock
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