Vitas-M small molecule compound
benzyl 6-amino-5-cyano-2-methyl-4-(thiophen-2-yl)-4H-pyran-3-carboxylate
Catalog ID
STK068081
SMILES N#CC1=C(N)OC(=C(C1c1cccs1)C(=O)OCc1ccccc1)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 C19H16N2O3S MW 352.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O3S/c1-12-16(19(22)23-11-13-6-3-2-4-7-13)17(15-8-5-9-25-15)14(10-20)18(21)24-12/h2-9,17H,11,21H2,1H3InChIKey
HTFUQCBXSXHNBW-UHFFFAOYSA-NSynonyms
327068-32-6327068326
4HPYRANE3CARBOXYLICACID6AMINO5CYANO2METHYL4(2THIENYL)BENZYLESTER
BENZYL6AMINO5CYANO2METHYL4(2THIENYL)4HPYRAN3CARBOXYLATE
BENZYL6AMINO5CYANO2METHYL4(THIOPHEN2YL)4HPYRAN3CARBOXYLATE
BENZYL6AMINO5CYANO2METHYL4THIOPHEN2YL4HPYRAN3CARBOXYLATE
CC1=C(C(C(=C(O1)N)C#N)C2=CC=CS2)C(=O)OCC3=CC=CC=C3
InChI=1SC19H16N2O3Sc11216(19(22)2311136324713)17(158592515)14(1020)18(21)2412h2917H1121H21H3
MFCD00743643
N#CC1=C(N)OC(=C(C1c1cccs1)C(=O)OCc1ccccc1)C
PHENYLMETHYL6AMINO5CYANO2METHYL4(2THIENYL)4HPYRAN3CARBOXYLATE
STK068081
ZINC000000705922
ZINC000000705923
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