Vitas-M small molecule compound

ethyl [(2Z)-5-(4-bromophenyl)-1,3,4-thiadiazol-2(3H)-ylidene]carbamate

Catalog ID
STK855601
SMILES CCOC(=O)/N=c\1/[nH]nc(s1)c1ccc(cc1)Br

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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 C11H10BrN3O2S MW 328.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H10BrN3O2S/c1-2-17-11(16)13-10-15-14-9(18-10)7-3-5-8(12)6-4-7/h3-6H,2H2,1H3,(H,13,15,16)
InChIKey
XSBUOMKXKBVQNW-UHFFFAOYSA-N
Synonyms

CCOC(=O)N=c1(nH)nc(s1)c1ccc(cc1)Br
CCOC(=O)NC1=NN=C(S1)C2=CC=C(C=C2)Br
ethyl((2Z)5(4bromophenyl)134thiadiazol2(3H)ylidene)carbamate
ETHYLN(5(4BROMOPHENYL)134THIADIAZOL2YL)CARBAMATE
InChI=1SC11H10BrN3O2Sc121711(16)131015149(1810)7358(12)647h36H2H21H3(H131516)
MFCD08736673
ZINC000008767819
ZINC8767819

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Available files

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