Vitas-M small molecule compound

ethyl 2-[(4-chlorobutanoyl)amino]-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate

Catalog ID
STK830974
SMILES ClCCCC(=O)Nc1sc2c(c1C(=O)OCC)CC(OC2)(C)C

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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 C16H22ClNO4S MW 359.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22ClNO4S/c1-4-21-15(20)13-10-8-16(2,3)22-9-11(10)23-14(13)18-12(19)6-5-7-17/h4-9H2,1-3H3,(H,18,19)
InChIKey
PGMSLNBPMROQIC-UHFFFAOYSA-N
Synonyms
118005-54-2
118005542
CCOC(=O)C1=C(SC2=C1CC(OC2)(C)C)NC(=O)CCCCl
ethyl2((4chlorobutanoyl)amino)55dimethyl47dihydro5Hthieno(23c)pyran3carboxylate
ethyl2(4chlorobutanamido)55dimethyl57dihydro4Hthieno(23c)pyran3carboxylate
ETHYL2(4CHLOROBUTANOYLAMINO)55DIMETHYL47DIHYDROTHIENO(23C)PYRAN3CARBOXYLATE
InChI=1SC16H22ClNO4Sc142115(20)1310816(23)22911(10)2314(13)1812(19)65717h49H213H3(H1819)
MFCD00396181
ZINC000002346380
ZINC02346380
ZINC2346380

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Available files

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