Vitas-M small molecule compound
prop-2-en-1-yl 6-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-5-cyano-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK887259
SMILES C=CCOC(=O)C1=C(C)NC(=C(C1c1ccccc1)C#N)SCC(=O)NCc1ccccc1
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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 C26H25N3O3S MW 459.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O3S/c1-3-14-32-26(31)23-18(2)29-25(21(15-27)24(23)20-12-8-5-9-13-20)33-17-22(30)28-16-19-10-6-4-7-11-19/h3-13,24,29H,1,14,16-17H2,2H3,(H,28,30)InChIKey
IINIGKHNVNYWHI-UHFFFAOYSA-NSynonyms
CC1=C(C(C(=C(N1)SCC(=O)NCC2=CC=CC=C2)C#N)C3=CC=CC=C3)C(=O)OCC=C
InChI=1SC26H25N3O3Sc13143226(31)2318(2)2925(21(1527)24(23)20128591320)331722(30)281619106471119h3132429H1141617H22H3(H2830)
MFCD10088110
prop2en1yl6((2(benzylamino)2oxoethyl)sulfanyl)5cyano2methyl4phenyl14dihydropyridine3carboxylate
prop2enyl6(2(benzylamino)2oxoethyl)sulfanyl5cyano2methyl4phenyl14dihydropyridine3carboxylate
ZINC000020348508
ZINC000020348510
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