Vitas-M small molecule compound
2-{[5-(3-nitrophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2E,3E)-4-phenylbut-3-en-2-ylidene]acetohydrazide
Catalog ID
STK555434
SMILES O=C(CSc1nnc(n1c1ccccc1)c1cccc(c1)[N+](=O)[O-])N/N=C(/C=C/c1ccccc1)\C
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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 C26H22N6O3S MW 498.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N6O3S/c1-19(15-16-20-9-4-2-5-10-20)27-28-24(33)18-36-26-30-29-25(31(26)22-12-6-3-7-13-22)21-11-8-14-23(17-21)32(34)35/h2-17H,18H2,1H3,(H,28,33)/b16-15+,27-19+InChIKey
DESNOGRPZUKFEY-JNDKSOAWSA-NSynonyms
347858-55-3(E)2((5(3nitrophenyl)4phenyl4H124triazol3yl)thio)N((E)4phenylbut3en2ylidene)acetohydrazide
2((5(3nitrophenyl)4phenyl124triazol3yl)sulfanyl)N((E)((E)4phenylbut3en2ylidene)amino)acetamide
2((5(3nitrophenyl)4phenyl4H124triazol3yl)sulfanyl)N((2E3E)4phenylbut3en2ylidene)acetohydrazide
347858553
CC(=NNC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC(=CC=C3)(N+)(=O)(O))C=CC4=CC=CC=C4
InChI=1SC26H22N6O3Sc119(15162094251020)272824(33)183626302925(31(26)22126371322)211181423(1721)32(34)35h217H18H21H3(H2833)b1615+2719+
MFCD02865718
O=C(CSc1nnc(n1c1ccccc1)c1cccc(c1)(N+)(=O)(O))NN=C(C=Cc1ccccc1)C
ZINC000009312346
ZINC102470887
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