Vitas-M small molecule compound
2-{[5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E)-1-phenylbutylidene]acetohydrazide
Catalog ID
STK558100
SMILES CCC/C(=N\NC(=O)CSc1nnc(n1C)c1cccc(c1)Cl)/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 C21H22ClN5OS MW 427.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN5OS/c1-3-8-18(15-9-5-4-6-10-15)23-24-19(28)14-29-21-26-25-20(27(21)2)16-11-7-12-17(22)13-16/h4-7,9-13H,3,8,14H2,1-2H3,(H,24,28)/b23-18+InChIKey
WSSSUKHUKBXPRF-PTGBLXJZSA-NSynonyms
347910-95-6(E)2((5(3chlorophenyl)4methyl4H124triazol3yl)thio)N(1phenylbutylidene)acetohydrazide
2((5(3chlorophenyl)4methyl124triazol3yl)sulfanyl)N((E)1phenylbutylideneamino)acetamide
2((5(3chlorophenyl)4methyl4H124triazol3yl)sulfanyl)N((1E)1phenylbutylidene)acetohydrazide
347910956
CCCC(=NNC(=O)CSC1=NN=C(N1C)C2=CC(=CC=C2)Cl)C3=CC=CC=C3
CCCC(=NNC(=O)CSc1nnc(n1C)c1cccc(c1)Cl)c1ccccc1
InChI=1SC21H22ClN5OSc13818(1595461015)232419(28)142921262520(27(21)2)161171217(22)1316h47913H3814H212H3(H2428)b2318+
MFCD06591185
ZINC000013750557
ZINC102479903
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