Vitas-M small molecule compound

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

Catalog ID
STK054866
SMILES COc1ccccc1/C=C/C=N/NC(=O)CSc1nnc(n1c1ccccc1)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 C26H23N5O2S MW 469.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N5O2S/c1-33-23-17-9-8-11-20(23)14-10-18-27-28-24(32)19-34-26-30-29-25(21-12-4-2-5-13-21)31(26)22-15-6-3-7-16-22/h2-18H,19H2,1H3,(H,28,32)/b14-10+,27-18+
InChIKey
UAZAQTCARYPPBG-IPHYAWPPSA-N
Synonyms
306756-51-4
(E)2((45diphenyl4H124triazol3yl)thio)N((E)3(2methoxyphenyl)allylidene)acetohydrazide
2((45DIPHENYL124TRIAZOL3YL)SULFANYL)N((E)((E)3(2METHOXYPHENYL)PROP2ENYLIDENE)AMINO)ACETAMIDE
2((45DIPHENYL4H124TRIAZOL3YL)SULFANYL)N((1E2E)3(2METHOXYPHENYL)PROP2EN1YLIDENE)ACETOHYDRAZIDE
306756514
COC1=CC=CC=C1C=CC=NNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4
COc1ccccc1C=CC=NNC(=O)CSc1nnc(n1c1ccccc1)c1ccccc1
InChI=1SC26H23N5O2Sc1332317981120(23)141018272824(32)193426302925(21124251321)31(26)22156371622h218H19H21H3(H2832)b1410+2718+
MFCD01841559
N((1E3E)4(2METHOXYPHENYL)1AZABUTA13DIENYL)2(45DIPHENYL(124TRIAZOL3YLTHIO))ACETAMIDE
STK054866
ZINC000001746502
ZINC4460370

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.