Vitas-M small molecule compound

(2E)-N-[(2Z)-5-(2-methoxyphenyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylprop-2-enamide

Catalog ID
STK608561
SMILES COc1ccccc1c1n[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 C18H15N3O2S MW 337.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N3O2S/c1-23-15-10-6-5-9-14(15)17-20-21-18(24-17)19-16(22)12-11-13-7-3-2-4-8-13/h2-12H,1H3,(H,19,21,22)/b12-11+
InChIKey
GQQVOOFVRDMKKA-VAWYXSNFSA-N
Synonyms

(2E)N((2Z)5(2methoxyphenyl)134thiadiazol2(3H)ylidene)3phenylprop2enamide
(E)N(5(2METHOXYPHENYL)134THIADIAZOL2YL)3PHENYLPROP2ENAMIDE
COC1=CC=CC=C1C2=NN=C(S2)NC(=O)C=CC3=CC=CC=C3
COc1ccccc1c1n(nH)c(=NC(=O)C=Cc2ccccc2)s1
InChI=1SC18H15N3O2Sc123151065914(15)17202118(2417)1916(22)1211137324813h212H1H3(H192122)b1211+
MFCD08732544
ZINC000017057005
ZINC17057005

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Available files

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