Vitas-M small molecule compound

methyl 5'-{[(4-tert-butylphenyl)carbonyl]amino}-2,3'-bithiophene-4'-carboxylate

Catalog ID
STK452941
SMILES COC(=O)c1c(scc1c1cccs1)NC(=O)c1ccc(cc1)C(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 C21H21NO3S2 MW 399.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO3S2/c1-21(2,3)14-9-7-13(8-10-14)18(23)22-19-17(20(24)25-4)15(12-27-19)16-6-5-11-26-16/h5-12H,1-4H3,(H,22,23)
InChIKey
BAAUPFPLQJUHRN-UHFFFAOYSA-N
Synonyms

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C(=CS2)C3=CC=CS3)C(=O)OC
InChI=1SC21H21NO3S2c121(23)149713(81014)18(23)221917(20(24)254)15(122719)1665112616h512H14H3(H2223)
METHYL2((4(TERTBUTYL)PHENYL)CARBONYLAMINO)4(2THIENYL)THIOPHENE3CARBOXYLATE
METHYL2((4TERTBUTYLBENZOYL)AMINO)42BITHIOPHENE3CARBOXYLATE
METHYL2((4TERTBUTYLBENZOYL)AMINO)4THIOPHEN2YLTHIOPHENE3CARBOXYLATE
methyl5(((4tertbutylphenyl)carbonyl)amino)23bithiophene4carboxylate
MFCD02373196
ZINC000002091499
ZINC02091499
ZINC2091499

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Available files

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