Vitas-M small molecule compound
4-({[5-(5-methyl-1H-pyrazol-3-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5-propylfuran-2-carbonitrile
Catalog ID
STK666113
SMILES CCCc1oc(cc1CSc1nnc(n1c1ccccc1)c1n[nH]c(c1)C)C#N
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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 C21H20N6OS MW 404.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N6OS/c1-3-7-19-15(11-17(12-22)28-19)13-29-21-26-25-20(18-10-14(2)23-24-18)27(21)16-8-5-4-6-9-16/h4-6,8-11H,3,7,13H2,1-2H3,(H,23,24)InChIKey
AVRIJVIUCBFVKG-UHFFFAOYSA-NSynonyms
4(((5(5methyl1Hpyrazol3yl)4phenyl4H124triazol3yl)sulfanyl)methyl)5propylfuran2carbonitrile
4((5(5METHYL1HPYRAZOL3YL)4PHENYL124TRIAZOL3YL)SULFANYLMETHYL)5PROPYLFURAN2CARBONITRILE
CCCC1=C(C=C(O1)C#N)CSC2=NN=C(N2C3=CC=CC=C3)C4=NNC(=C4)C
CCCc1oc(cc1CSc1nnc(n1c1ccccc1)c1n(nH)c(c1)C)C#N
InChI=1SC21H20N6OSc1371915(1117(1222)2819)132921262520(181014(2)232418)27(21)168546916h46811H3713H212H3(H2324)
MFCD06016483
ZINC000004624034
ZINC04624034
ZINC4624034
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