Vitas-M small molecule compound
tert-butyl 6-amino-5-cyano-2-methyl-4-(thiophen-2-yl)-4H-pyran-3-carboxylate
Catalog ID
STK759967
SMILES N#CC1=C(N)OC(=C(C1c1cccs1)C(=O)OC(C)(C)C)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 C16H18N2O3S MW 318.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O3S/c1-9-12(15(19)21-16(2,3)4)13(11-6-5-7-22-11)10(8-17)14(18)20-9/h5-7,13H,18H2,1-4H3InChIKey
PKLFFEFPPILVCW-UHFFFAOYSA-NSynonyms
CC1=C(C(C(=C(O1)N)C#N)C2=CC=CS2)C(=O)OC(C)(C)C
InChI=1SC16H18N2O3Sc1912(15(19)2116(23)4)13(116572211)10(817)14(18)209h5713H18H214H3
MFCD01571598
TERTBUTYL6AMINO5CYANO2METHYL4(2THIENYL)4HPYRAN3CARBOXYLATE
tertbutyl6amino5cyano2methyl4(thiophen2yl)4Hpyran3carboxylate
TERTBUTYL6AMINO5CYANO2METHYL4THIOPHEN2YL4HPYRAN3CARBOXYLATE
ZINC000000036794
ZINC000000036795
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