Vitas-M small molecule compound

N-[1-(4-bromobenzyl)-1H-1,2,4-triazol-3-yl]-3-chloro-1-benzothiophene-2-carboxamide

Catalog ID
STK897569
SMILES Brc1ccc(cc1)Cn1cnc(n1)NC(=O)c1sc2c(c1Cl)cccc2

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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 C18H12BrClN4OS MW 447.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12BrClN4OS/c19-12-7-5-11(6-8-12)9-24-10-21-18(23-24)22-17(25)16-15(20)13-3-1-2-4-14(13)26-16/h1-8,10H,9H2,(H,22,23,25)
InChIKey
AUFJOVMQXOCJLG-UHFFFAOYSA-N
Synonyms

C1=CC=C2C(=C1)C(=C(S2)C(=O)NC3=NN(C=N3)CC4=CC=C(C=C4)Br)Cl
InChI=1SC18H12BrClN4OSc19127511(6812)924102118(2324)2217(25)1615(20)13312414(13)2616h1810H9H2(H222325)
MFCD15119458
N(1((4bromophenyl)methyl)124triazol3yl)3chloro1benzothiophene2carboxamide
N(1(4bromobenzyl)1H124triazol3yl)3chloro1benzothiophene2carboxamide
ZINC000033114929
ZINC33114929

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Available files

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