Vitas-M small molecule compound

N'-[(1E,2E)-3-(2-methoxyphenyl)prop-2-en-1-ylidene]-2-{[4-(4-methylphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide

Catalog ID
STK090358
SMILES COc1ccccc1/C=C/C=N/NC(=O)CSc1nnc(n1c1ccc(cc1)C)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 C27H25N5O2S MW 483.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5O2S/c1-20-14-16-23(17-15-20)32-26(22-10-4-3-5-11-22)30-31-27(32)35-19-25(33)29-28-18-8-12-21-9-6-7-13-24(21)34-2/h3-18H,19H2,1-2H3,(H,29,33)/b12-8+,28-18+
InChIKey
PCDNXOAQPZFSCH-NMKRPIGBSA-N
Synonyms
314072-05-4
(E)N((E)3(2methoxyphenyl)allylidene)2((5phenyl4(ptolyl)4H124triazol3yl)thio)acetohydrazide
314072054
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC=CC3=CC=CC=C3OC)C4=CC=CC=C4
COc1ccccc1C=CC=NNC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccccc1
InChI=1SC27H25N5O2Sc120141623(171520)3226(22104351122)303127(32)351925(33)292818812219671324(21)342h318H19H212H3(H2933)b128+2818+
MFCD01916148
N((1E2E)3(2METHOXYPHENYL)PROP2EN1YLIDENE)2((4(4METHYLPHENYL)5PHENYL4H124TRIAZOL3YL)SULFANYL)ACETOHYDRAZIDE
N((E)((E)3(2METHOXYPHENYL)PROP2ENYLIDENE)AMINO)2((4(4METHYLPHENYL)5PHENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
STK090358
ZINC000001835876
ZINC33897401

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Available files

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