Vitas-M small molecule compound

methyl 4-[4-(butan-2-yl)phenyl]-2-{[(naphthalen-2-yloxy)acetyl]amino}thiophene-3-carboxylate

Catalog ID
STK448684
SMILES CCC(c1ccc(cc1)c1csc(c1C(=O)OC)NC(=O)COc1ccc2c(c1)cccc2)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 C28H27NO4S MW 473.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27NO4S/c1-4-18(2)19-9-11-21(12-10-19)24-17-34-27(26(24)28(31)32-3)29-25(30)16-33-23-14-13-20-7-5-6-8-22(20)15-23/h5-15,17-18H,4,16H2,1-3H3,(H,29,30)
InChIKey
QPYYUTWNAAONPR-UHFFFAOYSA-N
Synonyms

CCC(C)C1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)COC3=CC4=CC=CC=C4C=C3
InChI=1SC28H27NO4Sc1418(2)1991121(121019)24173427(26(24)28(31)323)2925(30)163323141320756822(20)1523h5151718H416H213H3(H2930)
methyl4(4(butan2yl)phenyl)2(((naphthalen2yloxy)acetyl)amino)thiophene3carboxylate
METHYL4(4(METHYLPROPYL)PHENYL)2(2(2NAPHTHYLOXY)ACETYLAMINO)THIOPHENE3CARBOXYLATE
methyl4(4butan2ylphenyl)2((2naphthalen2yloxyacetyl)amino)thiophene3carboxylate
MFCD06067832
ZINC000020568633
ZINC000020568635

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Available files

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