Vitas-M small molecule compound
2-{[5-(3-nitrophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-thiophen-2-ylmethylidene]acetohydrazide
Catalog ID
STL341108
SMILES O=C(CSc1nnc(n1c1ccccc1)c1cccc(c1)[N+](=O)[O-])N/N=C/c1cccs1
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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 C21H16N6O3S2 MW 464.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N6O3S2/c28-19(23-22-13-18-10-5-11-31-18)14-32-21-25-24-20(26(21)16-7-2-1-3-8-16)15-6-4-9-17(12-15)27(29)30/h1-13H,14H2,(H,23,28)/b22-13+InChIKey
IKKURIGKRKVBNE-LPYMAVHISA-NSynonyms
347404-31-3(E)2((5(3nitrophenyl)4phenyl4H124triazol3yl)thio)N(thiophen2ylmethylene)acetohydrazide
2((5(3NITROPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)N((E)THIOPHEN2YLMETHYLIDENEAMINO)ACETAMIDE
2((5(3nitrophenyl)4phenyl4H124triazol3yl)sulfanyl)N((E)thiophen2ylmethylidene)acetohydrazide
347404313
C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC3=CC=CS3)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC21H16N6O3S2c2819(23221318105113118)143221252420(26(21)167213816)1564917(1215)27(29)30h113H14H2(H2328)b2213+
MFCD01586520
O=C(CSc1nnc(n1c1ccccc1)c1cccc(c1)(N+)(=O)(O))NN=Cc1cccs1
ZINC000001841805
ZINC33345359
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