Vitas-M small molecule compound

methyl 2-{[(2,6-dichlorophenyl)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate

Catalog ID
STK429502
SMILES COC(=O)c1c(NC(=O)Cc2c(Cl)cccc2Cl)sc2c1CCCCC2

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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 C19H19Cl2NO3S MW 412.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19Cl2NO3S/c1-25-19(24)17-11-6-3-2-4-9-15(11)26-18(17)22-16(23)10-12-13(20)7-5-8-14(12)21/h5,7-8H,2-4,6,9-10H2,1H3,(H,22,23)
InChIKey
GLJYBJXLBFRNKU-UHFFFAOYSA-N
Synonyms

COC(=O)C1=C(SC2=C1CCCCC2)NC(=O)CC3=C(C=CC=C3Cl)Cl
InChI=1SC19H19Cl2NO3Sc12519(24)17116324915(11)2618(17)2216(23)101213(20)75814(12)21h578H246910H21H3(H2223)
methyl2(((26dichlorophenyl)acetyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
methyl2((2(26dichlorophenyl)acetyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
MFCD03233393
ZINC000002730522
ZINC02730522
ZINC2730522

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Available files

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