Vitas-M small molecule compound

2-{[5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2E)-1-phenylbutan-2-ylidene]acetohydrazide

Catalog ID
STK558452
SMILES CC/C(=N\NC(=O)CSc1nnc(n1C)c1cccc(c1)Cl)/Cc1ccccc1

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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 C21H22ClN5OS MW 427.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN5OS/c1-3-18(12-15-8-5-4-6-9-15)23-24-19(28)14-29-21-26-25-20(27(21)2)16-10-7-11-17(22)13-16/h4-11,13H,3,12,14H2,1-2H3,(H,24,28)/b23-18+
InChIKey
OLKOJNNQGWGNQH-PTGBLXJZSA-N
Synonyms
348590-65-8
(E)2((5(3chlorophenyl)4methyl4H124triazol3yl)thio)N(1phenylbutan2ylidene)acetohydrazide
2((5(3CHLOROPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)N((E)1PHENYLBUTAN2YLIDENEAMINO)ACETAMIDE
2((5(3chlorophenyl)4methyl4H124triazol3yl)sulfanyl)N((2E)1phenylbutan2ylidene)acetohydrazide
348590658
CCC(=NNC(=O)CSC1=NN=C(N1C)C2=CC(=CC=C2)Cl)CC3=CC=CC=C3
CCC(=NNC(=O)CSc1nnc(n1C)c1cccc(c1)Cl)Cc1ccccc1
InChI=1SC21H22ClN5OSc1318(12158546915)232419(28)142921262520(27(21)2)161071117(22)1316h41113H31214H212H3(H2428)b2318+
MFCD02611177
ZINC000009191041
ZINC33732324

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Available files

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