Vitas-M small molecule compound

6-[(5Z)-5-({9-methyl-2-[(2-methylpropyl)amino]-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoic acid

Catalog ID
STK904244
SMILES CC(CNc1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCCCCC(=O)O)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 C23H28N4O4S2 MW 488.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4O4S2/c1-14(2)13-24-19-16(21(30)26-11-7-8-15(3)20(26)25-19)12-17-22(31)27(23(32)33-17)10-6-4-5-9-18(28)29/h7-8,11-12,14,24H,4-6,9-10,13H2,1-3H3,(H,28,29)/b17-12-
InChIKey
NZCGEJPZZDBKSL-ATVHPVEESA-N
Synonyms
608497-22-9
(Z)6(5((2(isobutylamino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)4oxo2thioxothiazolidin3yl)hexanoicacid
6((5Z)5((9methyl2((2methylpropyl)amino)4oxo4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)hexanoicacid
6((5Z)5((9METHYL2(2METHYLPROPYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)HEXANOICACID
608497229
CC(CNc1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)CCCCCC(=O)O)C
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCCCCC(=O)O)NCC(C)C
InChI=1SC23H28N4O4S2c114(2)13241916(21(30)26117815(3)20(26)2519)121722(31)27(23(32)3317)10645918(28)29h7811121424H4691013H213H3(H2829)b1712
MFCD03685873
ZINC000009289729
ZINC9289729

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Available files

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