Vitas-M small molecule compound
3-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazol-4-amine
Catalog ID
STK593946
SMILES COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCc1ccc(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 C19H17N7O3S MW 423.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N7O3S/c1-29-15-8-4-13(5-9-15)16-10-17(22-21-16)18-23-24-19(25(18)20)30-11-12-2-6-14(7-3-12)26(27)28/h2-10H,11,20H2,1H3,(H,21,22)InChIKey
PKYGNIKHUKKHQA-UHFFFAOYSA-NSynonyms
879473-76-43(3(4methoxyphenyl)1Hpyrazol5yl)5((4nitrobenzyl)thio)4H124triazol4amine
3(3(4METHOXYPHENYL)1HPYRAZOL5YL)5((4NITROPHENYL)METHYLSULFANYL)124TRIAZOL4AMINE
3(3(4METHOXYPHENYL)PYRAZOL5YL)5((4NITROPHENYL)METHYLTHIO)124TRIAZOLE4YLAMINE
3(5(4methoxyphenyl)1Hpyrazol3yl)5((4nitrobenzyl)sulfanyl)4H124triazol4amine
879473764
COC1=CC=C(C=C1)C2=NNC(=C2)C3=NN=C(N3N)SCC4=CC=C(C=C4)(N+)(=O)(O)
COc1ccc(cc1)c1(nH)nc(c1)c1nnc(n1N)SCc1ccc(cc1)(N+)(=O)(O)
COc1ccc(cc1)c1n(nH)c(c1)c1nnc(n1N)SCc1ccc(cc1)(N+)(=O)(O)
InChI=1SC19H17N7O3Sc129158413(5915)161017(222116)18232419(25(18)20)3011122614(7312)26(27)28h210H1120H21H3(H2122)
MFCD07212173
ZINC000009450175
ZINC09450175
ZINC9450175
Check stock
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Check stock on Vitas-MAvailable files
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