Vitas-M small molecule compound

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

Catalog ID
STK412951
SMILES Clc1ccc(c(c1)Cl)OCC(=O)Nc1sc2c(c1C(=O)N)CCCCC2

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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 C18H18Cl2N2O3S MW 413.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18Cl2N2O3S/c19-10-6-7-13(12(20)8-10)25-9-15(23)22-18-16(17(21)24)11-4-2-1-3-5-14(11)26-18/h6-8H,1-5,9H2,(H2,21,24)(H,22,23)
InChIKey
AOBOBFMNQSJRMO-UHFFFAOYSA-N
Synonyms
419558-42-2
2(((24dichlorophenoxy)acetyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxamide
2((2(24dichlorophenoxy)acetyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxamide
419558422
C1CCC2=C(CC1)SC(=C2C(=O)N)NC(=O)COC3=C(C=C(C=C3)Cl)Cl
InChI=1SC18H18Cl2N2O3Sc19106713(12(20)810)25915(23)221816(17(21)24)114213514(11)2618h68H159H2(H22124)(H2223)
MFCD01339103
ZINC000002922106
ZINC02922106
ZINC2922106

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Available files

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