Vitas-M small molecule compound

ethyl 2-(but-3-enethioylamino)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-carboxylate

Catalog ID
STK015490
SMILES C=CCC(=S)Nc1nc2CC(C)(C)OCc2cc1C(=O)OCC

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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 C17H22N2O3S MW 334.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2O3S/c1-5-7-14(23)19-15-12(16(20)21-6-2)8-11-10-22-17(3,4)9-13(11)18-15/h5,8H,1,6-7,9-10H2,2-4H3,(H,18,19,23)
InChIKey
WPWNWAPTNBSACK-UHFFFAOYSA-N
Synonyms

C=CCC(=S)Nc1nc2CC(C)(C)OCc2cc1C(=O)OCC
CCOC(=O)C1=CC2=C(CC(OC2)(C)C)N=C1NC(=S)CC=C
ETHYL2(BUT3ENETHIOYLAMINO)77DIMETHYL58DIHYDROPYRANO(43B)PYRIDINE3CARBOXYLATE
ETHYL2(BUT3ENETHIOYLAMINO)77DIMETHYL78DIHYDRO5HPYRANO(43B)PYRIDINE3CARBOXYLATE
InChI=1SC17H22N2O3Sc15714(23)191512(16(20)2162)811102217(34)913(11)1815h58H167910H224H3(H181923)
MFCD08049600
STK015490
ZINC000006206710
ZINC06206710
ZINC6206710

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.