Vitas-M small molecule compound

ethyl 2-{[(3,4-dimethoxyphenyl)carbonyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate

Catalog ID
STK428286
SMILES CCOC(=O)c1c(NC(=O)c2ccc(c(c2)OC)OC)sc2c1CCCCCC2

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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 C22H27NO5S MW 417.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO5S/c1-4-28-22(25)19-15-9-7-5-6-8-10-18(15)29-21(19)23-20(24)14-11-12-16(26-2)17(13-14)27-3/h11-13H,4-10H2,1-3H3,(H,23,24)
InChIKey
QWPNVUHWPJJBTM-UHFFFAOYSA-N
Synonyms
419559-87-8
419559878
CCOC(=O)C1=C(SC2=C1CCCCCC2)NC(=O)C3=CC(=C(C=C3)OC)OC
ethyl2(((34dimethoxyphenyl)carbonyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
ethyl2((34dimethoxybenzoyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
InChI=1SC22H27NO5Sc142822(25)1915975681018(15)2921(19)2320(24)14111216(262)17(1314)273h1113H410H213H3(H2324)
MFCD01337383
ZINC000001200117
ZINC01200117
ZINC1200117

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Available files

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