Vitas-M small molecule compound
2-[(5-{[(4-chloro-2-methylphenyl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-[(E)-(2-fluorophenyl)methylidene]acetohydrazide
Catalog ID
STK957338
SMILES O=C(CSc1nnc(n1c1ccccc1)CNc1ccc(cc1C)Cl)N/N=C/c1ccccc1F
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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 C25H22ClFN6OS MW 509.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClFN6OS/c1-17-13-19(26)11-12-22(17)28-15-23-30-32-25(33(23)20-8-3-2-4-9-20)35-16-24(34)31-29-14-18-7-5-6-10-21(18)27/h2-14,28H,15-16H2,1H3,(H,31,34)/b29-14+InChIKey
JDNHKOLPQMWEKS-IPPBACCNSA-NSynonyms
834907-75-42((5(((4chloro2methylphenyl)amino)methyl)4phenyl4H124triazol3yl)sulfanyl)N((E)(2fluorophenyl)methylidene)acetohydrazide
2((5((4chloro2methylanilino)methyl)4phenyl124triazol3yl)sulfanyl)N((E)(2fluorophenyl)methylideneamino)acetamide
834907754
CC1=C(C=CC(=C1)Cl)NCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)NN=CC4=CC=CC=C4F
InChI=1SC25H22ClFN6OSc1171319(26)111222(17)281523303225(33(23)208324920)351624(34)312914187561021(18)27h21428H1516H21H3(H3134)b2914+
MFCD01431395
O=C(CSc1nnc(n1c1ccccc1)CNc1ccc(cc1C)Cl)NN=Cc1ccccc1F
ZINC000002738728
ZINC96577334
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