Vitas-M small molecule compound

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

Catalog ID
STK424348
SMILES CCOC(=O)c1c(NC(=O)c2ccc(cc2)OCC(C)C)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 C24H31NO4S MW 429.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31NO4S/c1-4-28-24(27)21-19-9-7-5-6-8-10-20(19)30-23(21)25-22(26)17-11-13-18(14-12-17)29-15-16(2)3/h11-14,16H,4-10,15H2,1-3H3,(H,25,26)
InChIKey
RROOBXFGZZDWEA-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC2=C1CCCCCC2)NC(=O)C3=CC=C(C=C3)OCC(C)C
ethyl2(((4(2methylpropoxy)phenyl)carbonyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
ethyl2((4(2methylpropoxy)benzoyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
InChI=1SC24H31NO4Sc142824(27)2119975681020(19)3023(21)2522(26)17111318(141217)291516(2)3h111416H41015H213H3(H2526)
MFCD01922119
ZINC000002752287
ZINC02752287
ZINC2752287

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Available files

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