Vitas-M small molecule compound

2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2-nitrophenyl)methylidene]acetohydrazide

Catalog ID
STK110054
SMILES COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)N/N=C/c1ccccc1[N+](=O)[O-]

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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 C24H19ClN6O4S MW 522.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19ClN6O4S/c1-35-20-12-6-16(7-13-20)23-28-29-24(30(23)19-10-8-18(25)9-11-19)36-15-22(32)27-26-14-17-4-2-3-5-21(17)31(33)34/h2-14H,15H2,1H3,(H,27,32)/b26-14+
InChIKey
XFMNSXWRGNLJAO-VULFUBBASA-N
Synonyms
378193-21-6
(E)2((4(4chlorophenyl)5(4methoxyphenyl)4H124triazol3yl)thio)N(2nitrobenzylidene)acetohydrazide
2((4(4CHLOROPHENYL)5(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N((E)(2NITROPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((4(4CHLOROPHENYL)5(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)N((E)(2NITROPHENYL)METHYLIDENE)ACETOHYDRAZIDE
378193216
COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NN=CC4=CC=CC=C4(N+)(=O)(O)
COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)NN=Cc1ccccc1(N+)(=O)(O)
InChI=1SC24H19ClN6O4Sc1352012616(71320)23282924(30(23)1910818(25)91119)361522(32)27261417423521(17)31(33)34h214H15H21H3(H2732)b2614+
MFCD02715336
N((1E)2(2NITROPHENYL)1AZAVINYL)2(4(4CHLOROPHENYL)5(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000001895815
ZINC101514221

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Available files

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