Vitas-M small molecule compound

2-[({3-[(4-bromophenoxy)methyl]phenyl}carbonyl)amino]-5-(propan-2-yl)thiophene-3-carboxamide

Catalog ID
STL176211
SMILES Brc1ccc(cc1)OCc1cccc(c1)C(=O)Nc1sc(cc1C(=O)N)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 C22H21BrN2O3S MW 473.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21BrN2O3S/c1-13(2)19-11-18(20(24)26)22(29-19)25-21(27)15-5-3-4-14(10-15)12-28-17-8-6-16(23)7-9-17/h3-11,13H,12H2,1-2H3,(H2,24,26)(H,25,27)
InChIKey
OEZPFZQIEJQJLI-UHFFFAOYSA-N
Synonyms
512815-69-9
2(((3((4bromophenoxy)methyl)phenyl)carbonyl)amino)5(propan2yl)thiophene3carboxamide
2(((3((4BROMOPHENOXY)METHYL)PHENYL)OXOMETHYL)AMINO)5PROPAN2YL3THIOPHENECARBOXAMIDE
2((3((4BROMANYLPHENOXY)METHYL)PHENYL)CARBONYLAMINO)5PROPAN2YLTHIOPHENE3CARBOXAMIDE
2((3((4BROMOPHENOXY)METHYL)BENZOYL)AMINO)5ISOPROPYL3THIOPHENECARBOXAMIDE
2((3((4BROMOPHENOXY)METHYL)BENZOYL)AMINO)5ISOPROPYLTHIOPHENE3CARBOXAMIDE
2((3((4BROMOPHENOXY)METHYL)BENZOYL)AMINO)5PROPAN2YLTHIOPHENE3CARBOXAMIDE
512815699
CC(C)C1=CC(=C(S1)NC(=O)C2=CC(=CC=C2)COC3=CC=C(C=C3)Br)C(=O)N
InChI=1SC22H21BrN2O3Sc113(2)191118(20(24)26)22(2919)2521(27)1553414(1015)1228178616(23)7917h31113H12H212H3(H22426)(H2527)
MFCD03467210
ZINC000000655545
ZINC00655545
ZINC655545

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Available files

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