Vitas-M small molecule compound

2-bromo-N-[5-({2-[(2-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide

Catalog ID
STK124384
SMILES O=C(Nc1ccccc1[N+](=O)[O-])CSc1nnc(s1)NC(=O)c1ccccc1Br

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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 C17H12BrN5O4S2 MW 494.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12BrN5O4S2/c18-11-6-2-1-5-10(11)15(25)20-16-21-22-17(29-16)28-9-14(24)19-12-7-3-4-8-13(12)23(26)27/h1-8H,9H2,(H,19,24)(H,20,21,25)
InChIKey
DZAIYDSGWFENLG-UHFFFAOYSA-N
Synonyms

2BROMON(5((2((2NITROPHENYL)AMINO)2OXOETHYL)SULFANYL)134THIADIAZOL2YL)BENZAMIDE
2BROMON(5(2(2NITROANILINO)2OXOETHYL)SULFANYL134THIADIAZOL2YL)BENZAMIDE
C1=CC=C(C(=C1)C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=CC=C3(N+)(=O)(O))Br
InChI=1SC17H12BrN5O4S2c1811621510(11)15(25)2016212217(2916)28914(24)1912734813(12)23(26)27h18H9H2(H1924)(H202125)
MFCD03356825
O=C(Nc1ccccc1(N+)(=O)(O))CSc1nnc(s1)NC(=O)c1ccccc1Br
ZINC000009833618
ZINC09833618
ZINC9833618

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Available files

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