Vitas-M small molecule compound
N'-[(E)-1,3-benzodioxol-5-ylmethylidene]-2-({4-phenyl-5-[(phenylamino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetohydrazide
Catalog ID
STK957558
SMILES O=C(CSc1nnc(n1c1ccccc1)CNc1ccccc1)N/N=C/c1ccc2c(c1)OCO2
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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 C25H22N6O3S MW 486.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N6O3S/c32-24(29-27-14-18-11-12-21-22(13-18)34-17-33-21)16-35-25-30-28-23(15-26-19-7-3-1-4-8-19)31(25)20-9-5-2-6-10-20/h1-14,26H,15-17H2,(H,29,32)/b27-14+InChIKey
ZPBWBJFBDASEFP-MZJWZYIUSA-NSynonyms
362680-49-72((5(ANILINOMETHYL)4PHENYL124TRIAZOL3YL)SULFANYL)N((E)13BENZODIOXOL5YLMETHYLIDENEAMINO)ACETAMIDE
362680497
C1OC2=C(O1)C=C(C=C2)C=NNC(=O)CSC3=NN=C(N3C4=CC=CC=C4)CNC5=CC=CC=C5
InChI=1SC25H22N6O3Sc3224(2927141811122122(1318)34173321)163525302823(1526197314819)31(25)2095261020h11426H1517H2(H2932)b2714+
MFCD01432603
N((E)13benzodioxol5ylmethylidene)2((4phenyl5((phenylamino)methyl)4H124triazol3yl)sulfanyl)acetohydrazide
O=C(CSc1nnc(n1c1ccccc1)CNc1ccccc1)NN=Cc1ccc2c(c1)OCO2
ZINC000000695432
ZINC33335378
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