Vitas-M small molecule compound

4,5-diphenyl-4H-1,2,4-triazol-3-yl (1E)-N-(3-chlorophenyl)-2-oxopropanehydrazonothioate

Catalog ID
STK733749
SMILES Clc1cccc(c1)N/N=C(\C(=O)C)/Sc1nnc(n1c1ccccc1)c1ccccc1

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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 C23H18ClN5OS MW 447.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClN5OS/c1-16(30)22(27-25-19-12-8-11-18(24)15-19)31-23-28-26-21(17-9-4-2-5-10-17)29(23)20-13-6-3-7-14-20/h2-15,25H,1H3/b27-22+
InChIKey
OWBMTJJHYMBJEF-HPNDGRJYSA-N
Synonyms

(45DIPHENYL124TRIAZOL3YL)(1E)N(3CHLOROANILINO)2OXOPROPANIMIDOTHIOATE
(E)45diphenyl4H124triazol3ylN(3chlorophenyl)2oxopropanehydrazonothioate
45diphenyl4H124triazol3yl(1E)N(3chlorophenyl)2oxopropanehydrazonothioate
CC(=O)C(=NNC1=CC(=CC=C1)Cl)SC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4
Clc1cccc(c1)NN=C(C(=O)C)Sc1nnc(n1c1ccccc1)c1ccccc1
InChI=1SC23H18ClN5OSc116(30)22(2725191281118(24)1519)3123282621(1794251017)29(23)20136371420h21525H1H3b2722+
MFCD02997246
ZINC000015986526
ZINC96901182

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Available files

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