Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(4-nitrophenyl)methylidene]acetohydrazide
Catalog ID
STK099742
SMILES O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C)N/N=C/c1ccc(cc1)[N+](=O)[O-]
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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 C27H26N6O3S MW 514.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N6O3S/c1-27(2,3)21-13-11-20(12-14-21)25-30-31-26(32(25)22-7-5-4-6-8-22)37-18-24(34)29-28-17-19-9-15-23(16-10-19)33(35)36/h4-17H,18H2,1-3H3,(H,29,34)/b28-17+InChIKey
JLBAHXXAXRLACJ-OGLMXYFKSA-NSynonyms
304451-54-5(E)2((5(4(tertbutyl)phenyl)4phenyl4H124triazol3yl)thio)N(4nitrobenzylidene)acetohydrazide
2((5(4tertbutylphenyl)4phenyl124triazol3yl)sulfanyl)N((E)(4nitrophenyl)methylideneamino)acetamide
2((5(4TERTBUTYLPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)N((E)(4NITROPHENYL)METHYLIDENE)ACETOHYDRAZIDE
304451545
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)NN=CC4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC27H26N6O3Sc127(23)21131120(121421)25303126(32(25)227546822)371824(34)2928171991523(161019)33(35)36h417H18H213H3(H2934)b2817+
MFCD02641911
O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C)NN=Cc1ccc(cc1)(N+)(=O)(O)
STK099742
ZINC000008818294
ZINC33891372
Check stock
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Check stock on Vitas-MAvailable files
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