Vitas-M small molecule compound
ethyl 5-cyano-6-{[2-oxo-2-(thiophen-2-yl)ethyl]sulfanyl}-2-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK827311
SMILES CCOC(=O)C1=C(NC(=C(C1c1cccs1)C#N)SCC(=O)c1cccs1)c1ccccc1
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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 C25H20N2O3S3 MW 492.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N2O3S3/c1-2-30-25(29)22-21(20-11-7-13-32-20)17(14-26)24(27-23(22)16-8-4-3-5-9-16)33-15-18(28)19-10-6-12-31-19/h3-13,21,27H,2,15H2,1H3InChIKey
YNCBUWDWWJCLHS-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=C(C1C2=CC=CS2)C#N)SCC(=O)C3=CC=CS3)C4=CC=CC=C4
ethyl5cyano6((2oxo2(thiophen2yl)ethyl)sulfanyl)2phenyl4(thiophen2yl)14dihydropyridine3carboxylate
ethyl5cyano6(2oxo2thiophen2ylethyl)sulfanyl2phenyl4thiophen2yl14dihydropyridine3carboxylate
InChI=1SC25H20N2O3S3c123025(29)2221(20117133220)17(1426)24(2723(22)168435916)331518(28)19106123119h3132127H215H21H3
MFCD10087599
ZINC000020348273
ZINC000020348275
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