Vitas-M small molecule compound

ethyl 6-amino-5-cyano-2-{[(3-cyano-6-phenylpyridin-2-yl)sulfanyl]methyl}-4-(thiophen-2-yl)-4H-pyran-3-carboxylate

Catalog ID
STL323977
SMILES CCOC(=O)C1=C(CSc2nc(ccc2C#N)c2ccccc2)OC(=C(C1c1cccs1)C#N)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 C26H20N4O3S2 MW 500.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20N4O3S2/c1-2-32-26(31)23-20(33-24(29)18(14-28)22(23)21-9-6-12-34-21)15-35-25-17(13-27)10-11-19(30-25)16-7-4-3-5-8-16/h3-12,22H,2,15,29H2,1H3
InChIKey
YKFUWCKYJPYHTR-UHFFFAOYSA-N
Synonyms
352662-82-9
352662829
CCOC(=O)C1=C(OC(=C(C1C2=CC=CS2)C#N)N)CSC3=C(C=CC(=N3)C4=CC=CC=C4)C#N
ETHYL(4S)6AMINO5CYANO2(((3CYANO6PHENYLPYRIDIN2YL)SULFANYL)METHYL)4(THIOPHEN2YL)4HPYRAN3CARBOXYLATE
ETHYL6AMINO5CYANO2(((3CYANO6PHENYL2PYRIDINYL)SULFANYL)METHYL)4(2THIENYL)4HPYRAN3CARBOXYLATE
ethyl6amino5cyano2(((3cyano6phenylpyridin2yl)sulfanyl)methyl)4(thiophen2yl)4Hpyran3carboxylate
ETHYL6AMINO5CYANO2(((3CYANO6PHENYLPYRIDIN2YL)SULFANYL)METHYL)4THIOPHEN2YL4HPYRAN3CARBOXYLATE
ethyl6amino5cyano2(((3cyano6phenylpyridin2yl)thio)methyl)4(thiophen2yl)4Hpyran3carboxylate
ETHYL6AMINO5CYANO2((3CYANO6PHENYLPYRIDIN2YL)SULFANYLMETHYL)4THIOPHEN2YL4HPYRAN3CARBOXYLATE
InChI=1SC26H20N4O3S2c123226(31)2320(3324(29)18(1428)22(23)2196123421)15352517(1327)101119(3025)167435816h31222H21529H21H3
MFCD01243091
ZINC000002056362
ZINC000002056363

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Available files

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