Vitas-M small molecule compound

propyl 2-[(pyridin-4-ylcarbonyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate

Catalog ID
STK440136
SMILES CCCOC(=O)c1c(sc2c1CCCCC2)NC(=O)c1ccncc1

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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 C19H22N2O3S MW 358.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N2O3S/c1-2-12-24-19(23)16-14-6-4-3-5-7-15(14)25-18(16)21-17(22)13-8-10-20-11-9-13/h8-11H,2-7,12H2,1H3,(H,21,22)
InChIKey
PQXLPMDDJVSHDR-UHFFFAOYSA-N
Synonyms

CCCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3=CC=NC=C3
InChI=1SC19H22N2O3Sc12122419(23)16146435715(14)2518(16)2117(22)138102011913h811H2712H21H3(H2122)
MFCD03385696
propyl2((pyridin4ylcarbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
propyl2(pyridine4carbonylamino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ZINC000002767273
ZINC02767273
ZINC2767273

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Available files

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