Vitas-M small molecule compound

2-{[4,5-bis(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(Z)-phenylmethylidene]acetohydrazide

Catalog ID
STK026331
SMILES O=C(CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)Cl)N/N=C\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 C23H17Cl2N5OS MW 482.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17Cl2N5OS/c24-18-8-6-17(7-9-18)22-28-29-23(30(22)20-12-10-19(25)11-13-20)32-15-21(31)27-26-14-16-4-2-1-3-5-16/h1-14H,15H2,(H,27,31)/b26-14-
InChIKey
CNJGAJSEIDQQAF-WGARJPEWSA-N
Synonyms

(E)Nbenzylidene2((45bis(4chlorophenyl)4H124triazol3yl)thio)acetohydrazide
2((45BIS(4CHLOROPHENYL)4H124TRIAZOL3YL)SULFANYL)N((Z)PHENYLMETHYLIDENE)ACETOHYDRAZIDE
C1=CC=C(C=C1)C=NNC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl
InChI=1SC23H17Cl2N5OSc24188617(7918)22282923(30(22)20121019(25)111320)321521(31)272614164213516h114H15H2(H2731)b2614
MFCD03220866
N((Z)BENZYLIDENEAMINO)2((45BIS(4CHLOROPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
O=C(CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)Cl)NN=Cc1ccccc1
STK026331
ZINC000030828581
ZINC01857394
ZINC1857394

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Available files

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