Vitas-M small molecule compound

ethyl 2-{[(2E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino}-1-benzothiophene-3-carboxylate

Catalog ID
STK420746
SMILES CCOC(=O)c1c(NC(=O)/C=C/c2ccc(cc2)C(C)(C)C)sc2c1cccc2

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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 C24H25NO3S MW 407.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25NO3S/c1-5-28-23(27)21-18-8-6-7-9-19(18)29-22(21)25-20(26)15-12-16-10-13-17(14-11-16)24(2,3)4/h6-15H,5H2,1-4H3,(H,25,26)/b15-12+
InChIKey
DEORWPWBLRHRBF-NTCAYCPXSA-N
Synonyms
445284-31-1
445284311
CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C=CC3=CC=C(C=C3)C(C)(C)C
CCOC(=O)c1c(NC(=O)C=Cc2ccc(cc2)C(C)(C)C)sc2c1cccc2
ethyl2(((2E)3(4tertbutylphenyl)prop2enoyl)amino)1benzothiophene3carboxylate
ETHYL2(((E)3(4TERTBUTYLPHENYL)PROP2ENOYL)AMINO)1BENZOTHIOPHENE3CARBOXYLATE
InChI=1SC24H25NO3Sc152823(27)2118867919(18)2922(21)2520(26)151216101317(141116)24(23)4h615H5H214H3(H2526)b1512+
MFCD02371412
ZINC000002751678
ZINC02751678
ZINC2751678

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Available files

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