Vitas-M small molecule compound

N-[(2E)-5-(butylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]thiophene-2-carboxamide

Catalog ID
STK607123
SMILES CCCCS(=O)(=O)c1n[nH]/c(=N\C(=O)c2cccs2)/s1

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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 C11H13N3O3S3 MW 331.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H13N3O3S3/c1-2-3-7-20(16,17)11-14-13-10(19-11)12-9(15)8-5-4-6-18-8/h4-6H,2-3,7H2,1H3,(H,12,13,15)
InChIKey
BRYKNVMAYYBUKU-UHFFFAOYSA-N
Synonyms
895850-76-7
895850767
CCCCS(=O)(=O)C1=NN=C(S1)NC(=O)C2=CC=CS2
CCCCS(=O)(=O)c1n(nH)c(=NC(=O)c2cccs2)s1
InChI=1SC11H13N3O3S3c123720(1617)11141310(1911)129(15)8546188h46H237H21H3(H121315)
MFCD08736844
N((2E)5(butylsulfonyl)134thiadiazol2(3H)ylidene)thiophene2carboxamide
N(5BUTYLSULFONYL134THIADIAZOL2YL)THIOPHENE2CARBOXAMIDE
ZINC000008768762
ZINC8768762

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Available files

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