Vitas-M small molecule compound
3-(3-chloro-1-benzothiophen-2-yl)-4-(4-methoxyphenyl)-5-[(2-phenylethyl)sulfanyl]-4H-1,2,4-triazole
Catalog ID
STK807528
SMILES COc1ccc(cc1)n1c(SCCc2ccccc2)nnc1c1sc2c(c1Cl)cccc2
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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 C25H20ClN3OS2 MW 478.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20ClN3OS2/c1-30-19-13-11-18(12-14-19)29-24(23-22(26)20-9-5-6-10-21(20)32-23)27-28-25(29)31-16-15-17-7-3-2-4-8-17/h2-14H,15-16H2,1H3InChIKey
XBMNNDHOUOGADX-UHFFFAOYSA-NSynonyms
1(3(3CHLOROBENZO(B)THIOPHEN2YL)5(2PHENYLETHYLTHIO)(124TRIAZOL4YL))4METHOXYBENZENE
3(3chloro1benzothiophen2yl)4(4methoxyphenyl)5((2phenylethyl)sulfanyl)4H124triazole
3(3chloro1benzothiophen2yl)4(4methoxyphenyl)5(2phenylethylsulfanyl)124triazole
3(3CHLORO1BENZOTHIOPHEN2YL)4(4METHOXYPHENYL)5PHENETHYLSULFANYL124TRIAZOLE
COC1=CC=C(C=C1)N2C(=NN=C2SCCC3=CC=CC=C3)C4=C(C5=CC=CC=C5S4)Cl
InChI=1SC25H20ClN3OS2c13019131118(121419)2924(2322(26)209561021(20)3223)272825(29)311615177324817h214H1516H21H3
MFCD05718534
ZINC000015441303
ZINC15441303
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