Vitas-M small molecule compound
4-(1-benzyl-1H-pyrazol-4-yl)-5-{4-[(4-chloro-1H-pyrazol-1-yl)methyl]phenyl}-4H-1,2,4-triazole-3-thiol
Catalog ID
STK311008
SMILES Clc1cnn(c1)Cc1ccc(cc1)c1nnc(n1c1cnn(c1)Cc1ccccc1)S
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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 C22H18ClN7S MW 447.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN7S/c23-19-10-24-28(14-19)13-17-6-8-18(9-7-17)21-26-27-22(31)30(21)20-11-25-29(15-20)12-16-4-2-1-3-5-16/h1-11,14-15H,12-13H2,(H,27,31)InChIKey
CWNXZGWIWWUSMJ-UHFFFAOYSA-NSynonyms
1005646-93-41005646934
4(1benzyl1Hpyrazol4yl)5(4((4chloro1Hpyrazol1yl)methyl)phenyl)4H124triazole3thiol
4(1benzylpyrazol4yl)3(4((4chloropyrazol1yl)methyl)phenyl)1H124triazole5thione
5(4((4CHLOROPYRAZOLYL)METHYL)PHENYL)4(1BENZYLPYRAZOL4YL)124TRIAZOLE3THIOL
C1=CC=C(C=C1)CN2C=C(C=N2)N3C(=NNC3=S)C4=CC=C(C=C4)CN5C=C(C=N5)Cl
InChI=1SC22H18ClN7Sc2319102428(1419)13176818(9717)21262722(31)30(21)20112529(1520)12164213516h1111415H1213H2(H2731)
MFCD04058852
ZINC000002808228
ZINC02808228
ZINC2808228
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