Vitas-M small molecule compound

ethyl 4-(4-tert-butylphenyl)-2-[(2-methylpropanoyl)amino]thiophene-3-carboxylate

Catalog ID
STK448577
SMILES CCOC(=O)c1c(scc1c1ccc(cc1)C(C)(C)C)NC(=O)C(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 C21H27NO3S MW 373.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27NO3S/c1-7-25-20(24)17-16(12-26-19(17)22-18(23)13(2)3)14-8-10-15(11-9-14)21(4,5)6/h8-13H,7H2,1-6H3,(H,22,23)
InChIKey
MULJAMHYSNGJKW-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C(C)(C)C)NC(=O)C(C)C
ETHYL4(4(TERTBUTYL)PHENYL)2(2METHYLPROPANOYLAMINO)THIOPHENE3CARBOXYLATE
ethyl4(4tertbutylphenyl)2((2methylpropanoyl)amino)thiophene3carboxylate
ETHYL4(4TERTBUTYLPHENYL)2(2METHYLPROPANOYLAMINO)THIOPHENE3CARBOXYLATE
InChI=1SC21H27NO3Sc172520(24)1716(122619(17)2218(23)13(2)3)1481015(11914)21(45)6h813H7H216H3(H2223)
MFCD02244846
ZINC000005953062
ZINC05953062
ZINC5953062

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Available files

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