Vitas-M small molecule compound

N-({2-[(2-bromo-4-methylphenoxy)acetyl]hydrazinyl}carbonothioyl)thiophene-2-carboxamide

Catalog ID
STL062589
SMILES O=C(COc1ccc(cc1Br)C)NNC(=S)NC(=O)c1cccs1

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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 C15H14BrN3O3S2 MW 428.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14BrN3O3S2/c1-9-4-5-11(10(16)7-9)22-8-13(20)18-19-15(23)17-14(21)12-3-2-6-24-12/h2-7H,8H2,1H3,(H,18,20)(H2,17,19,21,23)
InChIKey
PYLABPKGCSQVBZ-UHFFFAOYSA-N
Synonyms

CC1=CC(=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2=CC=CS2)Br
InChI=1SC15H14BrN3O3S2c194511(10(16)79)22813(20)181915(23)1714(21)123262412h27H8H21H3(H1820)(H217192123)
MFCD03592910
N(((2(2BROMO4METHYLPHENOXY)ACETYL)AMINO)CARBAMOTHIOYL)THIOPHENE2CARBOXAMIDE
N((2((2bromo4methylphenoxy)acetyl)hydrazinyl)carbonothioyl)thiophene2carboxamide
N((2((2BROMO4METHYLPHENOXY)ACETYL)HYDRAZINYL)CARBOTHIOYL)THIOPHENE2CARBOXAMIDE
ZINC000002551592
ZINC02551592
ZINC2551592

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Available files

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