Vitas-M small molecule compound

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

Catalog ID
STK768592
SMILES CCOC(=O)c1c(NC(=O)Cc2ccc(c(c2)OCC)OCC)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 C24H31NO5S MW 445.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31NO5S/c1-4-28-18-13-12-16(14-19(18)29-5-2)15-21(26)25-23-22(24(27)30-6-3)17-10-8-7-9-11-20(17)31-23/h12-14H,4-11,15H2,1-3H3,(H,25,26)
InChIKey
SGVGPPQRZWNVST-UHFFFAOYSA-N
Synonyms

CCOC1=C(C=C(C=C1)CC(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)OCC)OCC
ethyl2(((34diethoxyphenyl)acetyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ethyl2((2(34diethoxyphenyl)acetyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
InChI=1SC24H31NO5Sc142818131216(1419(18)2952)1521(26)252322(24(27)3063)17108791120(17)3123h1214H41115H213H3(H2526)
MFCD03308241
ZINC000002192740
ZINC02192740
ZINC2192740

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Available files

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