Vitas-M small molecule compound
3-[(4-nitrobenzyl)sulfanyl]-5-(5-phenyl-1H-pyrazol-3-yl)-4H-1,2,4-triazol-4-amine
Catalog ID
STK590152
SMILES Nn1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1c1cc([nH]n1)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 C18H15N7O2S MW 393.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N7O2S/c19-24-17(16-10-15(20-21-16)13-4-2-1-3-5-13)22-23-18(24)28-11-12-6-8-14(9-7-12)25(26)27/h1-10H,11,19H2,(H,20,21)InChIKey
XCNPHVQNFIURDA-UHFFFAOYSA-NSynonyms
879458-50-13((4nitrobenzyl)sulfanyl)5(5phenyl1Hpyrazol3yl)4H124triazol4amine
3((4nitrobenzyl)thio)5(3phenyl1Hpyrazol5yl)4H124triazol4amine
3((4NITROPHENYL)METHYLSULFANYL)5(3PHENYL1HPYRAZOL5YL)124TRIAZOL4AMINE
5((4NITROPHENYL)METHYLTHIO)3(3PHENYLPYRAZOL5YL)124TRIAZOLE4YLAMINE
879458501
C1=CC=C(C=C1)C2=NNC(=C2)C3=NN=C(N3N)SCC4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC18H15N7O2Sc192417(161015(202116)134213513)222318(24)2811126814(9712)25(26)27h110H1119H2(H2021)
MFCD07206806
Nn1c(SCc2ccc(cc2)(N+)(=O)(O))nnc1c1(nH)nc(c1)c1ccccc1
Nn1c(SCc2ccc(cc2)(N+)(=O)(O))nnc1c1cc((nH)n1)c1ccccc1
ZINC000009089489
ZINC09089489
ZINC9089489
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