Vitas-M small molecule compound
2-{[4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(4-nitrophenyl)methylidene]acetohydrazide
Catalog ID
STK104631
SMILES CCOc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(cc2)[N+](=O)[O-])nnc1c1ccccc1
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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 C25H22N6O4S MW 502.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N6O4S/c1-2-35-22-14-12-20(13-15-22)30-24(19-6-4-3-5-7-19)28-29-25(30)36-17-23(32)27-26-16-18-8-10-21(11-9-18)31(33)34/h3-16H,2,17H2,1H3,(H,27,32)/b26-16+InChIKey
DMQRPQBKBSYHLA-WGOQTCKBSA-NSynonyms
351515-28-1(E)2((4(4ethoxyphenyl)5phenyl4H124triazol3yl)thio)N(4nitrobenzylidene)acetohydrazide
2((4(4ETHOXYPHENYL)5PHENYL124TRIAZOL3YL)SULFANYL)N((E)(4NITROPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((4(4ETHOXYPHENYL)5PHENYL4H124TRIAZOL3YL)SULFANYL)N((E)(4NITROPHENYL)METHYLIDENE)ACETOHYDRAZIDE
351515281
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC3=CC=C(C=C3)(N+)(=O)(O))C4=CC=CC=C4
CCOc1ccc(cc1)n1c(SCC(=O)NN=Cc2ccc(cc2)(N+)(=O)(O))nnc1c1ccccc1
InChI=1SC25H22N6O4Sc123522141220(131522)3024(196435719)282925(30)361723(32)2726161881021(11918)31(33)34h316H217H21H3(H2732)b2616+
MFCD01586203
ZINC000002327530
ZINC33360707
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