Vitas-M small molecule compound

N-[(2Z)-5-[(4-nitrobenzyl)sulfanyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylpropanamide

Catalog ID
STK848635
SMILES O=C(/N=c\1/[nH]nc(s1)SCc1ccc(cc1)[N+](=O)[O-])CCc1ccccc1

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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 C18H16N4O3S2 MW 400.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4O3S2/c23-16(11-8-13-4-2-1-3-5-13)19-17-20-21-18(27-17)26-12-14-6-9-15(10-7-14)22(24)25/h1-7,9-10H,8,11-12H2,(H,19,20,23)
InChIKey
MLWACVSOGSAEHA-UHFFFAOYSA-N
Synonyms
476464-69-4
476464694
MFCD07203167
O=C(N=c1(nH)nc(s1)SCc1ccc(cc1)(N+)(=O)(O))CCc1ccccc1
ZINC000016977077

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Available files

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