Vitas-M small molecule compound
N'-[(1E)-1-(4-methylphenyl)ethylidene]-2-{[5-(3-nitrophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Catalog ID
STL340278
SMILES O=C(CSc1nnc(n1c1ccccc1)c1cccc(c1)[N+](=O)[O-])N/N=C(/c1ccc(cc1)C)\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 C25H22N6O3S MW 486.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N6O3S/c1-17-11-13-19(14-12-17)18(2)26-27-23(32)16-35-25-29-28-24(30(25)21-8-4-3-5-9-21)20-7-6-10-22(15-20)31(33)34/h3-15H,16H2,1-2H3,(H,27,32)/b26-18+InChIKey
PFOXFLLKQRZQHP-NLRVBDNBSA-NSynonyms
347878-96-0(E)2((5(3nitrophenyl)4phenyl4H124triazol3yl)thio)N(1(ptolyl)ethylidene)acetohydrazide
347878960
CC1=CC=C(C=C1)C(=NNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC(=CC=C4)(N+)(=O)(O))C
InChI=1SC25H22N6O3Sc117111319(141217)18(2)262723(32)163525292824(30(25)218435921)20761022(1520)31(33)34h315H16H212H3(H2732)b2618+
MFCD02865896
N((1E)1(4methylphenyl)ethylidene)2((5(3nitrophenyl)4phenyl4H124triazol3yl)sulfanyl)acetohydrazide
N((E)1(4methylphenyl)ethylideneamino)2((5(3nitrophenyl)4phenyl124triazol3yl)sulfanyl)acetamide
O=C(CSc1nnc(n1c1ccccc1)c1cccc(c1)(N+)(=O)(O))NN=C(c1ccc(cc1)C)C
ZINC000009313228
ZINC34378121
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