Vitas-M small molecule compound

methyl 2-({[4-(cyclopentyloxy)phenyl]carbonyl}amino)-4-(4-ethylphenyl)-5-methylthiophene-3-carboxylate

Catalog ID
STK429324
SMILES COC(=O)c1c(NC(=O)c2ccc(cc2)OC2CCCC2)sc(c1c1ccc(cc1)CC)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 C27H29NO4S MW 463.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29NO4S/c1-4-18-9-11-19(12-10-18)23-17(2)33-26(24(23)27(30)31-3)28-25(29)20-13-15-22(16-14-20)32-21-7-5-6-8-21/h9-16,21H,4-8H2,1-3H3,(H,28,29)
InChIKey
AOKFURMKCFPDTP-UHFFFAOYSA-N
Synonyms

CCC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)C3=CC=C(C=C3)OC4CCCC4)C
InChI=1SC27H29NO4Sc141891119(121018)2317(2)3326(24(23)27(30)313)2825(29)20131522(161420)3221756821h91621H48H213H3(H2829)
methyl2(((4(cyclopentyloxy)phenyl)carbonyl)amino)4(4ethylphenyl)5methylthiophene3carboxylate
METHYL2((4(CYCLOPENTYLOXY)BENZOYL)AMINO)4(4ETHYLPHENYL)5METHYL3THIOPHENECARBOXYLATE
METHYL2((4(CYCLOPENTYLOXY)BENZOYL)AMINO)4(4ETHYLPHENYL)5METHYLTHIOPHENE3CARBOXYLATE
METHYL2((4CYCLOPENTYLOXYBENZOYL)AMINO)4(4ETHYLPHENYL)5METHYLTHIOPHENE3CARBOXYLATE
METHYL2((4CYCLOPENTYLOXYPHENYL)CARBONYLAMINO)4(4ETHYLPHENYL)5METHYLTHIOPHENE3CARBOXYLATE
MFCD03233727
ZINC000002105407
ZINC02105407
ZINC2105407

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Available files

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