Vitas-M small molecule compound

5-acetyl-2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-6-methyl-4-propyl-1,4-dihydropyridine-3-carbonitrile

Catalog ID
STK758878
SMILES CCCC1C(=C(SCC(=O)c2ccc(cc2)Br)NC(=C1C(=O)C)C)C#N

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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 C20H21BrN2O2S MW 433.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21BrN2O2S/c1-4-5-16-17(10-22)20(23-12(2)19(16)13(3)24)26-11-18(25)14-6-8-15(21)9-7-14/h6-9,16,23H,4-5,11H2,1-3H3
InChIKey
VSSZUBYDXODZSN-UHFFFAOYSA-N
Synonyms

5acetyl2((2(4bromophenyl)2oxoethyl)sulfanyl)6methyl4propyl14dihydropyridine3carbonitrile
5ACETYL2(2(4BROMOPHENYL)2OXOETHYL)SULFANYL6METHYL4PROPYL14DIHYDROPYRIDINE3CARBONITRILE
5ACETYL2(2(4BROMOPHENYL)2OXOETHYLTHIO)6METHYL4PROPYL14DIHYDROPYRIDINE3CARBONITRILE
CCCC1C(=C(NC(=C1C(=O)C)C)SCC(=O)C2=CC=C(C=C2)Br)C#N
InChI=1SC20H21BrN2O2Sc1451617(1022)20(2312(2)19(16)13(3)24)261118(25)146815(21)9714h691623H4511H213H3
MFCD01460357
ZINC000001023159
ZINC000001023160

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Available files

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