Vitas-M small molecule compound

(2E)-N-[(2Z)-5-({2-[(4-acetylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylprop-2-enamide

Catalog ID
STK850998
SMILES O=C(Nc1ccc(cc1)C(=O)C)CSc1n[nH]/c(=N/C(=O)/C=C/c2ccccc2)/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 C21H18N4O3S2 MW 438.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O3S2/c1-14(26)16-8-10-17(11-9-16)22-19(28)13-29-21-25-24-20(30-21)23-18(27)12-7-15-5-3-2-4-6-15/h2-12H,13H2,1H3,(H,22,28)(H,23,24,27)/b12-7+
InChIKey
VFNHGZPODMUBNP-KPKJPENVSA-N
Synonyms
531535-96-3
531535963
MFCD07212338
O=C(Nc1ccc(cc1)C(=O)C)CSc1n(nH)c(=NC(=O)C=Cc2ccccc2)s1

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Available files

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